TCM-ID Component

Description of the Component

Component ID	TCMH544
Latin Name	Curcuma aeruginosa
English Name	Zedoray rhizome
Chinese Pinyin Name	E Zhu
中文名	莪术
TCM Properties	Warm,Pungent,Bitter
TCM Meridians	Spleen,Liver
Therapeutic Class English	Blood activation and stasis removal
Therapeutic Class Chinese	活血化淤
Functions	promote the flow of qi and eliminate blood stasis with strong effect, and relieve pain by removing the stagnation of undigested food
Toxicity	NA
Geo-authentic habitats (道地产区)	NA
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAN2146-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx2947	An Yang Gao Yao	安阳膏药
TCMFx2971	An Yang Jing Zhi Ointment	安阳精制膏
TCMF1373	Aucklandiae and Arecae Pills	木香槟榔丸
TCMFx1442	Awei Huapi Plaster	阿魏化痞膏
TCMFx2622	Awei Huapi Plaster	阿魏化痞膏
TCMF869	Chai Hu Shu Gan Pills	柴胡舒肝丸
TCMFx6865	Chen Xiang Hua Qi Capsules	沉香化气胶囊
TCMF3146	Chen Xiang Hua Qi Tablets	沉香化气片
TCMF3155	Chen Xiang Hua Zhi Pills	沉香化滞丸
TCMF3660	Cu Zhi Xiang Fu Pills	醋制香附丸
TCMFx3755	Da Huang Hua Yu Pills	大黄化瘀丸
TCMFx3786	Da Li Yao Wine	大力药酒
TCMF6963	Dan E Fu Kang Jian Ointment	丹莪妇康煎膏
TCMF353	Dan Gui Xiang Granules	丹桂香颗粒
TCMF3	Dan Xiang Qing Zhi Granules	丹香清脂颗粒
TCMFx3341	Die Da Bang Yao Wine	跌打榜药酒
TCMFx3348	Die Da Feng Shi Wine	跌打风湿酒
TCMF3355	Die Da Feng Shi Yao Wine	跌打风湿药酒
TCMF3410	Die Da Sun Shang Pills	跌打损伤丸
TCMFx3418	Die Da Wan Hua You	跌打万花油
TCMFx3426	Die Da Yao Wine	跌打药酒
TCMF3505	Ding Xiang Lan Fan Pills	丁香烂饭丸
TCMFx3743	Du Ji Du Jiao Ointment	杜记独角膏
TCMF1909	Ectopic Pregnancy Decoction	宫外孕方
TCMF3934	Er Tong Qing Re Dao Zhi Pills	儿童清热导滞丸
TCMF190	Er Tong Qing Re Dao Zhi Pills	儿童清热导滞丸
TCMF3221	Fu Fang Ban Mao Capsules	复方斑蝥胶囊
TCMFx3916	Fu Ke Tong Jing Pills	妇科通经丸
TCMFx3932	Fu Ke Wu Jin Pills	妇科乌金丸
TCMFx3029	Fu Ning Shuan	妇宁栓
TCMFx6998	Fu Ping Capsules	妇平胶囊
TCMF539	Fu Yan Kang Tablet	妇炎康片
TCMF3077	Fu Yan Kang Tablets	妇炎康片
TCMF3502	Gan Lu Ointment	甘露膏
TCMFx3377	Gu Lou Shan Die Da Pills	古楼山跌打丸
TCMFx3369	Gu Lou Shan Die Da Wine	古楼山跌打酒
TCMFx3498	Gu Song Bao Granules	骨松宝颗粒
TCMF3888	Guang Dong Shen Qu	广东神曲
TCMFx4144	Hai Ma Wan Ying Ointment	海马万应膏
TCMF4319	He Luo Shu Gan Capsules	和络舒肝胶囊
TCMF4327	He Luo Shu Gan Tablets	和络舒肝片
TCMFx4433	Hong Hua Die Da Pills	红花跌打丸
TCMF4497	Hong Mao Yao Wine	鸿茅药酒
TCMF4749	Hu Po Li Qi Pills	琥珀利气丸
TCMFx362	Hua Ji Oral Liquid	化积口服液
TCMFx4282	Hun Yuan Pills	混元丸
TCMFx4761	Jia Wei Lan Ji Pills	加味烂积丸
TCMF4811	Jia Wei Si Xiao Pills	加味四消丸
TCMFx4881	Jia Yu Ruan Jian Ointment	甲鱼软坚膏
TCMF4302	Jian Shen Xiao Dao Infusion	健身消导冲剂
TCMF4589	Jiang Zhuo Jian Mei Tea	降浊健美茶
TCMF714	Jin Pu Capsule	金蒲胶囊
TCMFx4132	Jin Sang San Jie Capsules	金嗓散结胶囊
TCMFx4139	Jin Sang San Jie Pills	金嗓散结丸
TCMFx718	Jin Sang San Jie Pills	金嗓散结丸
TCMFx7180	Jing Shu Capsules	经舒胶囊
TCMFx4836	Kai Xiong Li Qi Pills	开胸理气丸
TCMFx253	Kai Xiong Shun Qi Capsule	开胸顺气胶囊
TCMF4851	Kai Yu Lao Kou Pills	开郁老蔻丸
TCMF4859	Kai Yu Shu Gan Pills	开郁舒肝丸
TCMF4414	Ke Tong Ding	克痛酊
TCMFx4581	Kuan Zhong Shun Qi Pills	宽中顺气丸
TCMF4767	Lan Ji Pills	烂积丸
TCMF4783	Lao Fan Zhi Wan Ying Shen Qu	老范志万应神曲
TCMF4799	Lao Kou Pills	老蔻丸
TCMF4870	Li Qi Shu Xin Tablets	理气舒心片
TCMFx4186	Liang Cai Xin Die Da Pills	梁财信跌打丸
TCMFx96	Ling Ze Tablets	灵泽片
TCMF4586	Liu Yu Pills	六郁丸
TCMFx4545	Mo Ji Powder	磨积散
TCMF4612	Mu Xiang Fen Qi Pills	木香分气丸
TCMF4620	Mu Xiang Li Qi Tablets	木香理气片
TCMFx4378	Nv Bao Capsules	女宝胶囊
TCMF469	Piao Chen Hua Yu Pills	朴沉化郁丸
TCMF2330	Pills of Aucklandiae and Arecae	木香槟榔丸
TCMF4714	Pu Chen Hua Yu Pills	朴沉化郁丸
TCMF5754	Qing Wei He Zhong Pills	清胃和中丸
TCMFx5006	Qing Yu Bi Wen Dan	庆余辟瘟丹
TCMFx490	Qing Yu Pi Wen Dan	庆余辟瘟丹
TCMFx884	Qu Shang Xiao Zhong Tincture	祛伤消肿酊
TCMF5297	Quan Zhou Bai Cao Qu	泉州百草曲
TCMF7	Ru Kang Capsule	乳康胶囊
TCMF6	Ru Kang Pills	乳康丸
TCMF5670	Ru Kang Tablets	乳康片
TCMF659	Ru Pi San Jie Capsule	乳癖散结胶囊
TCMF5721	Ruan Jian Yao Decoction	软坚药水
TCMFx5121	San Qi Yao Wine	三七药酒
TCMF7339	San Zhong Kui Jian Decoction	散肿溃坚汤
TCMFx5552	Shan Zha Nei Xiao Pills	山楂内消丸
TCMFx7011	Shang Granulesng Spray	伤科灵喷雾剂
TCMFx5662	Shang Ke Die Da Pills	伤科跌打丸
TCMFx5654	Shang Ke Die Da Tablets	伤科跌打片
TCMFx5694	Shang Ke Wan Hua You	伤科万花油
TCMFx6989	Shang Tong Die Da Pills	伤痛跌打丸
TCMFx5878	Shao Lin Feng Shi Die Da Ointment	少林风湿跌打膏
TCMFx5886	Shao Lin Zheng Gu Jing	少林正骨精
TCMFx5091	She Xiang Feng Shi Die Da Ointment	麝香风湿跌打膏
TCMFx5140	She Xiang Hui Yang Ointment	麝香回阳膏
TCMF3352	Shen Mei Yang Wei Infusion	参梅养胃冲剂
TCMF5839	Sheng Ji Bie Jia Pills	圣济鳖甲丸
TCMF5032	Shi Xiang Ding Tong Pills	十香定痛丸
TCMF5335	Shu Gan Diao Qi Pills	舒肝调气丸
TCMF5486	Shu Qi Pills	舒气丸
TCMFx5764	Shui Peng Ointment	水蓬膏
TCMFx1619	Suppository for Relieving Woman Diseases	妇宁栓
TCMF5620	Tiao Jing Hua Yu Pills	调经化瘀丸
TCMF5674	Tiao Jing Zhi Bao Pills	调经至宝丸
TCMF5691	Tiao Jing Zi Mei Pills	调经姊妹丸
TCMF5086	Tong Jing Bao Granules	痛经宝颗粒
TCMF1101	Tong Jing Bao Granules	痛经宝颗粒
TCMF5816	Tong Jing Gan Lu Pills	通经甘露丸
TCMF5133	Tou Feng Ointment	头风膏
TCMFx5163	Tou Gu Zhen Feng Pills	透骨镇风丸
TCMF5198	Tui Zhang Yan Ointment	退障眼膏
TCMFx5284	Wai Yong Wan Ying Ointment	外用万应膏
TCMF5332	Wan Ling Jin Gu Ointment	万灵筋骨膏
TCMF5385	Wan Ying Bao Zhen Ointment	万应宝珍膏
TCMF5650	Wei Huo Ling Tablets	胃活灵片
TCMF7062	Wei Li Kang Granules	胃力康颗粒
TCMF2828	Wen Jing Decoction	温经汤
TCMFx5338	Wu Di Zhi Tong Cha Ji	无敌止痛搽剂
TCMFx5477	Wu Jia Pills	五瘕丸
TCMFx5246	Wu Jin Pills	乌金丸
TCMFx5239	Wu Jin Tablets	乌金片
TCMFx5254	Wu Jin Zhi Tong Pills	乌金止痛丸
TCMFx6717	Xiao Er Hua Shi Pills	小儿化食丸
TCMFx237	Xiao Er Hua Shi Oral Liquid	小儿化食口服液
TCMFx238	Xiao Er Hua Shi Pills	小儿化食丸
TCMFx6419	Xiao Er Xiao Ji Hua Chong Powder	小儿消积化虫散
TCMF6425	Xiao Er Xiao Ji Pills	小儿消积丸
TCMFx6102	Xiao Ji Hua Zhi Tablets	消积化滞片
TCMF6126	Xiao Ji Pills	消积丸
TCMF6244	Xiao Pi A Wei Pills	消痞阿魏丸
TCMFx6496	Xiao Zhong Zhi Tong Ding	消肿止痛酊
TCMFx1021	Xiao Zhong Zhi Tong Tincture	消肿止痛酊
TCMF6788	Yang Pi Powder	养脾散
TCMF6735	Yang Xian Feng Dian Pills	羊痫疯癫丸
TCMF835	Yang Zheng Xiao Ji Capsule	养正消积胶囊
TCMFx6232	Ying Er Xiao Shi Powder	婴儿消食散
TCMF691	Yu Jin Yin Xie Tablet	郁金银屑片
TCMF6465	Yu Jin Yin Xie Tablets	郁金银屑片
TCMFx6690	Yun Xiang Jing	云香精
TCMFx9	Yun Xiang Qu Feng Zhi Tong Tincture	云香祛风止痛酊
TCMFx6833	Zhang Zhou Shen Qu	漳州神曲
TCMFx6317	Zheng Gu Decoction	正骨水
TCMFx397	Zheng Gu Shui	正骨水
TCMFx321	Zhi Tong Hua Zheng Capsule	止痛化症胶囊
TCMF6634	Zhi Tong Hua Zheng Capsules	止痛化症胶囊
TCMFx320	Zhi Tong Hua Zheng Tablet	止痛化症片

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT133	CA1	Carbonic anhydrase I	Lyase	P00915
TCMT134	CA2	Carbonic anhydrase II	Lyase	P00918
TCMT135	CA14	Carbonic anhydrase XIV	Lyase	Q9ULX7
TCMT136	CA12	Carbonic anhydrase XII	Lyase	O43570
TCMT137	CA9	Carbonic anhydrase IX	Lyase	Q16790
TCMT138	CA7	Carbonic anhydrase VII	Lyase	P43166
TCMT139	CA6	Carbonic anhydrase VI	Lyase	P23280
TCMT140	CA5B	Carbonic anhydrase VB	Lyase	Q9Y2D0
TCMT141	CA5A	Carbonic anhydrase VA	Lyase	P35218
TCMT142	CA4	Carbonic anhydrase IV	Lyase	P22748
TCMT143	CA3	Carbonic anhydrase III	Lyase	P07451
TCMT150	RORC	Nuclear receptor ROR-gamma	Nuclear receptor	P51449
TCMT156	CYP19A1	Cytochrome P450 19A1	Oxidoreductase	P11511
TCMT159	TYR	Tyrosinase	Oxidoreductase	P14679
TCMT161	HCAR2	Hydroxycarboxylic acid receptor 2	GPCR	Q8TDS4
TCMT166	AKR1C2	Aldo-keto reductase family 1 member C2	Oxidoreductase	P52895
TCMT167	AKR1C3	Aldo-keto-reductase family 1 member C3	Oxidoreductase	P42330
TCMT168	AKR1C4	Aldo-keto reductase family 1 member C4	Oxidoreductase	P17516
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636
TCMT223	AKR1B1	Aldose reductase	Oxidoreductase	P15121
TCMT236	ESR2	Estrogen receptor beta	Nuclear receptor	Q92731
TCMT280	AKR1B10	Aldo-keto reductase family 1 member B10	Oxidoreductase	O60218
TCMT281	DPP4	Dipeptidyl peptidase IV	Unclassified	P27487
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT41	IDH1	Isocitrate dehydrogenase [NADP] cytoplasmic	Oxidoreductase	O75874
TCMT423	EGFR	Epidermal growth factor receptor erbB1	Kinase	P00533
TCMT80	MAPK1	MAP kinase ERK2	Kinase	P28482
TCMT82	ESR1	Estrogen receptor alpha	Nuclear receptor	P03372

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1104	Sortase
TCMT1212	Verticillium dahliae
TCMT1218	Staphylococcus aureus
TCMT1253	Penicillium chrysogenum
TCMT1454	Bacillus subtilis
TCMT1462	Streptococcus mutans

Ingredient Structrues

Ingredient ID: TCMC995
Formula: C35H60O6

Common Name	Daucosterol
IUPAC Name	(2R,3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	CC[C@@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)C
Standard InCHI	InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1
Standard InCHIKey	NPJICTMALKLTFW-OFUAXYCQSA-N
External Identifiers	ChEMBL [CHEMBL506678]; PubChem [5742590];
Reference of Component-Ingredient Pair	16261518

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH86	Ampelopsis japonica	Bai Lian	白蔹
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸
TCMH600	Euonymus fortunei	Fu Fang Teng	扶芳藤
TCMH1673	Gentiana macrophylla	Qin Jiao	秦艽
TCMH2595	Rhododendron micranthum	Zhao Shan Bai	照山白
TCMH1739	Ficus microcarpa	Rong Shu Ye	榕树叶
TCMH945	Sophora japonica	Huai Zhi	槐枝
TCMH284	Melia toosendan	Chuan Lian Zi	川楝子
TCMH1656	Angelica decursiva	Qian Hu	前胡
TCMH695	Uncaria rhynchophylla	Gou Teng	钩藤
TCMH1865	Paeonia obovata	Shao Yao	芍药
TCMH1264	Litchi chinensis	Li Zhi He	荔枝核
TCMH1011	Sargentodoxa cuneata	Huo Xue Teng	活血藤
TCMH2166	Clematis chinensis	Wei Ling Xian	威灵仙
TCMH1144	Schizonepetae herba	Jing Jie Tan	荆芥炭
TCMH63	Lilium brownii	Bai He Liu Jin Gao	百合流浸膏
TCMH803	Massa hanshi fermentata	Han Shi	寒食
TCMH271	Clerodendrum trichotomum	Chou Wu Tong Ye	臭梧桐叶
TCMH1348	Liquidambar formosana	Lu Lu Tong	路路通
TCMH123	Pteris semipinnata	Ban Bian Qi	半边旗
TCMH2513	Rhododendron mucronulatum	Ying Shan Hong	映山红
TCMH2134	Smilax glabra	Tu Fu Ling	土茯苓
TCMH1830	Anisodus tanguticus	Shan Lang Dang	山莨菪
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH845	Auricularia auricula-judae	Hei Mu Er	黑木耳
TCMH1740	Cistanche deserticola	Rou Cong Rong	肉苁蓉
TCMH1796	Morus alba	Sang Shen Qing Gao	桑葚清膏
TCMH844	Breynia fruticosa	Hei Mian Shen	黑面神
TCMH2185	Acanthopanax gracilistylus	Wu Jia Pi	五加皮
TCMH1674	Gentiana straminea	Qin Jiao Hua	秦艽花
TCMH274	Fritillaria cirrhosa	Chuan Bei Mu Liu Jin Gao	川贝母流浸膏
TCMH1562	Arctium lappa	Niu Bang Zi	牛蒡子
TCMH2244	Prunella vulgaris	Xia Ku Cao	夏枯草
TCMH1460	Zanthoxylum nitidum	Mao Liang Mian Zhen	毛两面针
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH2491	Alpinia oxyphylla	Yi Zhi Ren	益智仁
TCMH2137	Pogostemon cablin	Tu Huo Xiang	土藿香
TCMH985	Astragalus membranaceus	Huang Qi Ti Qu Ye	黄芪提取液
TCMH2515	Papaver somniferum	Ying Su Ke	罂粟壳
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH2218	Rubia cordifolia	Qian Cao Teng	茜草藤
TCMH2556	Polygala tenuifolia	Yuan Zhi Liu Jin Gao	远志流浸膏
TCMH2436	Elaeagnus pungens	Yang Nai Nai Ye	羊奶奶叶
TCMH367	Caulis sargentodoxae	Da Huo Xue	大活血
TCMH741	Fructus choerospondiatis	Guang Zao	广枣
TCMH2077	Prunus persica	Tao Zhi	桃枝
TCMH213	Boschniakia rossica	Cao Cong Rong	草苁蓉
TCMH1105	Trollius chinensis	Jin Lian Hua	金莲花
TCMH748	Euonymus alatus	Gui Jian Yu	鬼箭羽
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH207	Fructus xanthii sibirici	Cang Er Zi Jin Gao Fen	苍耳子浸膏粉
TCMH1894	Pinellia ternata	Sheng Ban Xia	生半夏
TCMH409	Salvia miltiorrhiza	Dan Shen Jin Gao	丹参浸膏
TCMH445	Hypericum japonicum	Di Er Cao	地耳草
TCMH2275	Dracocephalum moldavica	Xiang Qing Lan	香青兰
TCMH2462	Crataegus pinnatifida	Ye Shan Zha	野山楂
TCMH1122	Psammosilene tunicoides	Jin Tie Suo	金铁锁
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH1950	Herba selaginellae doederleinii	Shi Shang Bai	石上柏
TCMH1299	Ganoderma lucidum	Ling Zhi(1)	灵芝
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH1519	Oroxylum indicum	Mu Hu Die	木蝴蝶
TCMH2286	Berberis julianae	Xiao Bo Gen	小檗根
TCMH1446	Vaccinium oxycoccos	Man Yue Mei	蔓越莓
TCMH2090	Gastrodia elata	Tian Ma	天麻
TCMH1523	Oleum viticis negundo	Mu Jing You	牡荆油
TCMH2232	Scutellaria amoena	Xi Nan Huang Qin	西南黄芩
TCMH2726	Pterocarpus indicus	Zi Tan	紫檀
TCMH1522	Folium viticis negundo	Mu Jing Ye	牡荆叶
TCMH1393	Verbena officinalis	Ma Bian Cao	马鞭草
TCMH829	Semen pharbitidis	Hei Chou	黑丑
TCMH366	Rheum officinale	Da Huang Liu Jin Gao	大黄流浸膏
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH255	Vigna angularis	Chi Dou	赤豆
TCMH1197	Selaginella tamariscina	Juan Bai	卷柏
TCMH37	Smilax china	Ba Qia	菝葜
TCMH287	Clematidis armandii caulis	Chuan Mu Tong	川木通
TCMH1078	Fructus gardeniae preparata	Jiao Shan Zhi	焦山栀
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH1285	Orobanche coerulescens	Lie Dang	列当
TCMH1798	Morus alba	Sang Zhi	桑枝
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1823	Alpinia zerumbet	Shan Jiang	山姜
TCMH1889	Lycopodium japonicum	Shen Jin Cao	伸筋草
TCMH2263	Isodon amethystoides	Xiang Cha Cai	香茶菜
TCMH1117	Rhizoma fagopyri cymosi	Jin Qiao Mai	金荞麦
TCMH1958	Diospyros kaki	Shi Ye	柿叶
TCMH1396	Portulaca oleracea	Ma Chi Xian	马齿苋
TCMH1371	Arachis hypogaea	Luo Hua Sheng Zhi Ye	落花生枝叶
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH1539	Cucurbita moschata	Nan Gua	南瓜
TCMH1038	Spatholobus suberectus	Ji Xue Teng Gao	鸡血藤膏
TCMH1766	Sparganium stoloniferum	San Ling	三棱
TCMH1032	Impatiens balsamina	Ji Xing Zi	急性子
TCMH1660	Senecio scandens	Qian Li Guang	千里光
TCMH864	Aster ageratoides	Hong Guan Yao	红管药
TCMH1121	Cardiospermum halicacabum	Jin Si Ku Lian	金丝苦楝
TCMH500	Benincasa hispida	Dong Gua Zi	冬瓜子
TCMH563	Anisomeles indica	Fang Feng Cao	防风草
TCMH2356	Daemonorops draco	Xue Xie	血蝎
TCMH1448	Mangifera indica	Mang Guo Ye	芒果叶
TCMH2117	Lepidium apetalum	Ting Li Zi	葶苈子
TCMH2371	Juniperus formosana	Yan Bai	岩柏
TCMH1176	Allium tuberosum	Jiu Zi	韭子
TCMH1588	Achyranthes bidentata	Niu Xi	牛膝
TCMH1135	Rosa laevigata	Jin Ying Zi Ti Qu Ye	金樱子提取液
TCMH2511	Zanthoxylum avicennae	Ying Bu Bo	鹰不泊
TCMH76	Thlaspi arvense	Bai Jiang Cao	败酱草
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1179	Citri exocarpium rubrum	Ju Hong	橘红
TCMH1132	Radix rosae laevigatae	Jin Ying Gen	金樱根
TCMH348	Lobelia chinensis	Da Ban Bian Lian	大半边莲
TCMH562	Saposhnikovia divaricata	Fang Feng	防风
TCMH906	Viscum coloratum	Hu Ji Sheng	槲寄生
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1305	Laggera alata	Liu Ling Ju	六棱菊
TCMH1428	Ophiopogon japonicus	Mai Men Dong	麦门冬
TCMH1965	Rheum palmatum	Shu Da Huang	熟大黄
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH2213	Ipomoea cairica	Wu Zhao Long	五爪龙
TCMH2092	Asparagus cochinchinensis	Tian Men Dong	天门冬
TCMH1777	Panax notoginseng	San Qi Ye Jing	三七叶茎
TCMH385	Sargentodoxa cuneata	Da Xue Teng	大血藤
TCMH1155	Allium tuberosum	Jiu Cai	韭菜
TCMH149	Lepidium apetalum	Bei Ting Li Zi	北葶苈子
TCMH2116	Lepidium apetalum	Ting Li Cao	葶苈草
TCMH590	Impatiens balsamina	Feng Xian Hua	凤仙花
TCMH591	Impatiens balsamina	Feng Xian Tou Gu Cao	凤仙透骨草
TCMH1759	Asparagus cochinchinensis	San Bai Bang	三百棒
TCMH2084	Asparagus cochinchinensis	Tian Dong	天冬
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH737	Crataegus pinnatifida	Guang Shan Zha	广山楂
TCMH1848	Crataegus pinnatifida	Shan Zha	山楂
TCMH1849	Crataegus pinnatifida	Shan Zha Chou Gao	山楂稠膏
TCMH1852	Crataegus pinnatifida	Shan Zha Qing Gao	山楂清膏
TCMH1853	Crataegus pinnatifida	Shan Zha Tan	山楂炭
TCMH1175	Cornus officinalis	Jiu Yu Rou	酒萸肉
TCMH273	Fritillaria cirrhosa	Chuan Bei Mu	川贝母
TCMH918	Elaeagnus pungens	Hu Tui Zi Ye	胡颓子叶
TCMH122	Lobelia chinensis	Ban Bian Lian	半边莲
TCMH62	Lilium brownii	Bai He	百合
TCMH2071	Prunus persica	Tao	桃
TCMH2073	Prunus persica	Tao Ren	桃仁
TCMH2074	Prunus persica	Tao Ren Shuang	桃仁霜
TCMH1584	Achyranthes bidentata	Niu Teng	牛藤
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH498	Benincasa hispida	Dong Gua Pi	冬瓜皮
TCMH52	Semen pharbitidis	Bai Chou	白丑
TCMH1185	Lycium chinense	Gou Qi	枸杞
TCMH592	Liquidambar formosana	Feng Xiang Ye	枫香叶
TCMH594	Liquidambar formosana	Feng Xiang Zhi Chou Gao	枫香脂稠膏
TCMH1738	Ficus microcarpa	Rong Shu Xu	榕树须
TCMH270	Clerodendrum trichotomum	Chou Wu Tong	臭梧桐
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH131	Pinellia ternata	Ban Xia Qu	半夏曲
TCMH1677	Pinellia ternata	Qing Ban Xia	清半夏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH938	Sophora japonica	Huai Hua	槐花
TCMH940	Sophora japonica	Huai Jiao	槐角
TCMH941	Sophora japonica	Huai Mi	槐米
TCMH363	Rheum officinale	Da Huang	大黄
TCMH365	Rheum officinale	Da Huang Jin Gao	大黄浸膏
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH258	Paeonia obovata	Chi Shao	赤芍
TCMH1770	Panax notoginseng	San Qi Gan Jin Gao	三七干浸膏
TCMH1771	Panax notoginseng	San Qi Gao Fen	三七膏粉
TCMH1772	Panax notoginseng	San Qi Hua	三七花
TCMH1774	Panax notoginseng	San Qi Jing Ye	三七茎叶
TCMH1776	Panax notoginseng	San Qi Ye	三七叶
TCMH2488	Alpinia oxyphylla	Yi Zhi	益智
TCMH206	Fructus xanthii sibirici	Cang Er Zi	苍耳子
TCMH981	Astragalus membranaceus	Huang Qi	黄芪
TCMH983	Astragalus membranaceus	Huang Qi Gan Jin Gao	黄芪干浸膏
TCMH984	Astragalus membranaceus	Huang Qi Jin Gao	黄芪浸膏
TCMH1296	Ganoderma lucidum	Ling Zhi Jin Gao	灵芝浸膏
TCMH209	Anisodus tanguticus	Cang Qie Gen	藏茄根
TCMH2554	Polygala tenuifolia	Yuan Zhi	远志
TCMH2555	Polygala tenuifolia	Yuan Zhi Jin Gao	远志浸膏
TCMH469	Spatholobus suberectus	Dian Ji Xue Teng Gao Fen	滇鸡血藤膏粉
TCMH1036	Spatholobus suberectus	Ji Xue Teng	鸡血藤
TCMH1037	Spatholobus suberectus	Ji Xue Teng Gan Gao	鸡血藤干膏
TCMH1792	Morus alba	Sang Pi	桑皮
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶
TCMH519	Pogostemon cablin	Du Huo Xiang	杜藿香
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香
TCMH1008	Pogostemon cablin	Huo Xiang	藿香
TCMH1009	Pogostemon cablin	Huo Xiang Ye	藿香叶
TCMH1927	Diospyros kaki	Shi Di	柿蒂
TCMH2082	Acanthopanax gracilistylus	Teng Wu Jia Gen	藤五加根
TCMH2139	Acanthopanax gracilistylus	Tu Jia Pi	土加皮
TCMH2152	Acanthopanax gracilistylus	Tu Wu Jia	土五加
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH930	Arachis hypogaea	Hua Sheng	花生
TCMH931	Arachis hypogaea	Hua Sheng Mi	花生米
TCMH407	Salvia miltiorrhiza	Dan Shen	丹参
TCMH408	Salvia miltiorrhiza	Dan Shen Gan Jin Gao	丹参干浸膏
TCMH2164	Clematis chinensis	Wei Ling	威灵
TCMH1794	Morus alba	Sang Shen	桑葚
TCMH1795	Morus alba	Sang Shen Jin Gao	桑葚浸膏
TCMH1133	Rosa laevigata	Jin Ying Zi	金樱子
TCMH1134	Rosa laevigata	Jin Ying Zi Rou	金樱子肉
TCMH1423	Ophiopogon japonicus	Mai Dong	麦冬
TCMH1424	Ophiopogon japonicus	Mai Dong Men	麦冬门
TCMH1425	Ophiopogon japonicus	Mai Dong Rou	麦冬肉
TCMH1489	Papaver somniferum	Mi Ying Su Ke	蜜罂粟壳
TCMH2514	Papaver somniferum	Ying Su	罂粟

Ingredient ID: TCMC948
Formula: C9H8O3

Common Name	Coumaric Acid
IUPAC Name	(E)-3-(4-hydroxyphenyl)prop-2-enoic acid
Canonical SMILES	OC(=O)/C=C/c1ccc(cc1)O
Standard InCHI	InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+
Standard InCHIKey	NGSWKAQJJWESNS-ZZXKWVIFSA-N
External Identifiers	ChEMBL [CHEMBL66879]; PubChem [637542];
Reference of Component-Ingredient Pair	23800587

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸
TCMH2367	Linum usitatissimum	Ya Ma Zi	亚麻子
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH382	Allium sativum	Da Suan	大蒜
TCMH101	Chelidonium majus	Bai Qu Cai	白屈菜
TCMH2506	Ginkgo biloba	Yin Xing Ye	银杏叶
TCMH1144	Schizonepetae herba	Jing Jie Tan	荆芥炭
TCMH63	Lilium brownii	Bai He Liu Jin Gao	百合流浸膏
TCMH143	Albizia julibrissin	Bei He Huan	北合欢
TCMH1693	Aristolochia debilis	Qing Mu Xiang	青木香
TCMH2040	Liquidambar orientalis	Su He Xiang	苏合香
TCMH1633	Taraxacum mongolicum	Pu Gong Ying Jin Gao	蒲公英浸膏
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH921	Polygonum cuspidatum	Hu Zhang	虎杖
TCMH2244	Prunella vulgaris	Xia Ku Cao	夏枯草
TCMH2642	Gardenia jasminoides	Zhi Zi Jin Gao	栀子浸膏
TCMH1146	Oryza sativa	Jing Mi	粳米
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1498	Ranunculus ternatus	Mao Zhao Cao	猫爪草
TCMH25	Styrax benzoin	An Xi Xiang	安息香
TCMH2337	Flos inulae	Xuan Fu Hua	旋覆花
TCMH2696	Phyllostachys nigra	Zhu Ye	竹叶
TCMH2515	Papaver somniferum	Ying Su Ke	罂粟壳
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH213	Boschniakia rossica	Cao Cong Rong	草苁蓉
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH910	Tadehagi triquetrum	Hu Lu Cha	葫芦茶
TCMH1096	Inula japonica	Jin Fei Cao	金沸草
TCMH449	Cortex lycii radicis	Di Gu Pi	地骨皮
TCMH2462	Crataegus pinnatifida	Ye Shan Zha	野山楂
TCMH526	Eucommia ulmoides	Du Zhong Ye	杜仲叶
TCMH1992	Polygonum orientale	Shui Hong Hua Ye	水红花叶
TCMH1322	Solanum nigrum	Long Kui	龙葵
TCMH1446	Vaccinium oxycoccos	Man Yue Mei	蔓越莓
TCMH859	Ormosia hosiei	Hong Dou	红豆
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH2232	Scutellaria amoena	Xi Nan Huang Qin	西南黄芩
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH255	Vigna angularis	Chi Dou	赤豆
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH1798	Morus alba	Sang Zhi	桑枝
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1854	Crataegi folium	Shan Zha Ye	山楂叶
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH1117	Rhizoma fagopyri cymosi	Jin Qiao Mai	金荞麦
TCMH1396	Portulaca oleracea	Ma Chi Xian	马齿苋
TCMH2297	Cirsium setosum	Xiao Ji	小蓟
TCMH1766	Sparganium stoloniferum	San Ling	三棱
TCMH1660	Senecio scandens	Qian Li Guang	千里光
TCMH1118	Lygodium japonicum	Jin Sha Teng	金沙藤
TCMH314	Ailanthus altissima	Chun Gen Pi	椿根皮
TCMH2370	Commelina communis	Ya Zhi Cao	鸭跖草
TCMH1448	Mangifera indica	Mang Guo Ye	芒果叶
TCMH1339	Phragmites communis	Lu Gen	芦根
TCMH1466	Rosa rugosa	Mei Gui Hua	玫瑰花
TCMH936	Platycarya strobilacea	Hua Xiang Shu Guo Xu	化香树果序
TCMH71	Oldenlandia diffusa	Bai Hua She She Cao	白花蛇舌草
TCMH132	Scutellaria barbata	Ban Zhi Lian	半枝莲
TCMH2558	Rosa chinensis	Yue Ji Hua	月季花
TCMH718	Aristolochia manshuriensis	Guan Mu Tong	关木通
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH1142	Schizonepetae spica	Jing Jie Sui	荆芥穗
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH2553	Scrophularia ningpoensis	Yuan Shen	元参
TCMH2069	Aconitum tanguticum	Tang Gu Te Wu Tou	唐古特乌头
TCMH737	Crataegus pinnatifida	Guang Shan Zha	广山楂
TCMH1848	Crataegus pinnatifida	Shan Zha	山楂
TCMH1849	Crataegus pinnatifida	Shan Zha Chou Gao	山楂稠膏
TCMH1852	Crataegus pinnatifida	Shan Zha Qing Gao	山楂清膏
TCMH1853	Crataegus pinnatifida	Shan Zha Tan	山楂炭
TCMH1175	Cornus officinalis	Jiu Yu Rou	酒萸肉
TCMH62	Lilium brownii	Bai He	百合
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH524	Eucommia ulmoides	Du Zhong	杜仲
TCMH525	Eucommia ulmoides	Du Zhong Tan	杜仲炭
TCMH1185	Lycium chinense	Gou Qi	枸杞
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH310	Melia azedarach	Chuan Lian	川楝
TCMH1211	Melia azedarach	Ku Lian Pi	苦楝皮
TCMH780	Lygodium japonicum	Hai Jin Sha	海金砂
TCMH781	Lygodium japonicum	Hai Jin Sha Cao	海金沙草
TCMH782	Lygodium japonicum	Hai Jin Sha Teng	海金沙藤
TCMH783	Lygodium japonicum	Hai Jin Sha Teng Gan Jin Gao	海金沙藤干浸膏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH473	Phyllostachys nigra	Dian Zhu Ye	滇竹叶
TCMH1397	Aristolochia debilis	Ma Dou Ling	马兜铃
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH978	Taraxacum mongolicum	Huang Miao	黄苗
TCMH1632	Taraxacum mongolicum	Pu Gong Ying	蒲公英
TCMH935	Platycarya strobilacea	Hua Xiang Shu Guo	化香树果
TCMH1792	Morus alba	Sang Pi	桑皮
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH61	Ginkgo biloba	Bai Guo Ren	白果仁
TCMH292	Notopterygium incisum	Chuan Qiang Huo	川羌活
TCMH1991	Polygonum orientale	Shui Hong Hua	水红花
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH1489	Papaver somniferum	Mi Ying Su Ke	蜜罂粟壳
TCMH2514	Papaver somniferum	Ying Su	罂粟
TCMH1856	Gardenia jasminoides	Shan Zhi	山栀
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子
TCMH2343	Scrophularia ningpoensis	Xuan Shen	玄参

Ingredient ID: TCMC7369
Formula: C15H24O2

Common Name	3-Hydroperoxy-2,6,6,9-Tetramethylcycloundeca-1,4,8-Triene
IUPAC Name	(1Z,4E,8Z)-3-hydroperoxy-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Canonical SMILES	OOC1/C=C/C(C)(C)C/C=C(CC/C=C1/C)/C
Standard InCHI	InChI=1S/C15H24O2/c1-12-6-5-7-13(2)14(17-16)9-11-15(3,4)10-8-12/h7-9,11,14,16H,5-6,10H2,1-4H3/b11-9+,12-8-,13-7-
Standard InCHIKey	MMMUNNUIKCPGAL-RTTFEGKLSA-N
External Identifiers	ChEMBL [N/A]; PubChem [131752029];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC7368
Formula: C15H16O2

Common Name	(S)-1,5,8-Trimethyl-7,8-Dihydronaphtho[2,1-B]Furan-9(6H)-One
IUPAC Name	1,5,8-trimethyl-7,8-dihydro-6H-benzo[e][1]benzofuran-9-one
Canonical SMILES	CC1CCc2c(C1=O)c1c(C)coc1cc2C
Standard InCHI	InChI=1S/C15H16O2/c1-8-4-5-11-9(2)6-12-13(10(3)7-17-12)14(11)15(8)16/h6-8H,4-5H2,1-3H3
Standard InCHIKey	YBJIFGYQRRWWFW-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [131751498];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC7316
Formula: C11H10O

Common Name	Azulen-5-Ylmethanol
IUPAC Name	azulen-5-ylmethanol
Canonical SMILES	OCc1cccc2c(c1)ccc2
Standard InCHI	InChI=1S/C11H10O/c12-8-9-3-1-4-10-5-2-6-11(10)7-9/h1-7,12H,8H2
Standard InCHIKey	YTJZRHVGZOVOMX-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [124121996];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC7105
Formula: C15H18O3

Common Name	(8S,8As)-8-Hydroxy-3,5,8A-Trimethyl-7,8,8A,9-Tetrahydronaphtho[2,3-B]Furan-4(6H)-One
IUPAC Name	(8S,8aS)-8-hydroxy-3,5,8a-trimethyl-6,7,8,9-tetrahydrobenzo[f][1]benzofuran-4-one
Canonical SMILES	CC1=C2C(=O)c3c(C[C@@]2([C@H](CC1)O)C)occ3C
Standard InCHI	InChI=1S/C15H18O3/c1-8-4-5-11(16)15(3)6-10-12(9(2)7-18-10)14(17)13(8)15/h7,11,16H,4-6H2,1-3H3/t11-,15+/m0/s1
Standard InCHIKey	PFIXJSCFTAVWBW-XHDPSFHLSA-N
External Identifiers	ChEMBL [N/A]; PubChem [101289704];
Reference of Component-Ingredient Pair	20491080

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6955
Formula: C15H20O2

Common Name	(5Z,9Z)-3,6,10-Trimethyl-7,8,11,11A-Tetrahydrocyclodeca[B]Furan-2(4H)-One
IUPAC Name	(5Z,9Z)-3,6,10-trimethyl-7,8,11,11a-tetrahydro-4H-cyclodeca[b]furan-2-one
Canonical SMILES	C/C/1=C/CC/C(=CCC2=C(C(=O)OC2C1)C)/C
Standard InCHI	InChI=1S/C15H20O2/c1-10-5-4-6-11(2)9-14-13(8-7-10)12(3)15(16)17-14/h6-7,14H,4-5,8-9H2,1-3H3/b10-7-,11-6-
Standard InCHIKey	SLGKCOCDZZQQLY-LXQMTTSMSA-N
External Identifiers	ChEMBL [N/A]; PubChem [90471896];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6887
Formula: C15H24O

Common Name	2-Methyl-6-(4-Methylcyclohexa-1,4-Dienyl)Heptan-4-One
IUPAC Name	2-methyl-6-(4-methylcyclohexa-1,4-dien-1-yl)heptan-4-one
Canonical SMILES	CC(CC(=O)CC(C1=CCC(=CC1)C)C)C
Standard InCHI	InChI=1S/C15H24O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,8,11,13H,6-7,9-10H2,1-4H3
Standard InCHIKey	FRFQUSZMLRIVJP-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [71407235];
Reference of Component-Ingredient Pair	8011097

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6880
Formula: C15H24O

Common Name	(S)-2-Methyl-6-(4-Methylcyclohex-3-En-1-Yl)Hepta-2,6-Dien-1-Ol
IUPAC Name	2-methyl-6-[(1S)-4-methylcyclohex-3-en-1-yl]hepta-2,6-dien-1-ol
Canonical SMILES	OCC(=CCCC(=C)[C@H]1CCC(=CC1)C)C
Standard InCHI	InChI=1S/C15H24O/c1-12-7-9-15(10-8-12)14(3)6-4-5-13(2)11-16/h5,7,15-16H,3-4,6,8-11H2,1-2H3/t15-/m1/s1
Standard InCHIKey	HBVOEGGRCJCMLG-OAHLLOKOSA-N
External Identifiers	ChEMBL [N/A]; PubChem [71355833];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6757
Formula: C15H18O3

Common Name	(4As,5S,7As)-4A-Hydroxy-3,5-Dimethyl-8-Methylene-5,6,7,7A,8,9-Hexahydroazuleno[6,5-B]Furan-4(4Ah)-One
IUPAC Name	(5aS,8S,8aS)-8a-hydroxy-1,8-dimethyl-5-methylidene-5a,6,7,8-tetrahydro-4H-azuleno[6,5-b]furan-9-one
Canonical SMILES	C=C1Cc2occ(c2C(=O)[C@]2([C@H]1CC[C@@H]2C)O)C
Standard InCHI	InChI=1S/C15H18O3/c1-8-6-12-13(9(2)7-18-12)14(16)15(17)10(3)4-5-11(8)15/h7,10-11,17H,1,4-6H2,2-3H3/t10-,11-,15-/m0/s1
Standard InCHIKey	CKDRPCYJCDMPFO-PGUXBMHVSA-N
External Identifiers	ChEMBL [N/A]; PubChem [46173920];
Reference of Component-Ingredient Pair	25564049

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6613
Formula: C15H24O2

Common Name	(3R,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione
IUPAC Name	(3R,6Z,10S)-6,10-dimethyl-3-propan-2-ylcyclodec-6-ene-1,4-dione
Canonical SMILES	C/C/1=C/CC[C@H](C)C(=O)C[C@@H](C(=O)C1)C(C)C
Standard InCHI	InChI=1S/C15H24O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,10,12-13H,5,7-9H2,1-4H3/b11-6-/t12-,13+/m0/s1
Standard InCHIKey	KDPFMRXIVDLQKX-BLJGWETHSA-N
External Identifiers	ChEMBL [N/A]; PubChem [24836956];
Reference of Component-Ingredient Pair	26281553

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6612
Formula: C15H22O2

Common Name	(3E,7Z)-10-(1-Hydroxypropan-2-Ylidene)-3,7-Dimethylcyclodeca-3,7-Dienone
IUPAC Name	(3Z,7Z,10E)-10-(1-hydroxypropan-2-ylidene)-3,7-dimethylcyclodeca-3,7-dien-1-one
Canonical SMILES	OC/C(=C/1C/C=C(/C)CC/C=C(CC1=O)/C)/C
Standard InCHI	InChI=1S/C15H22O2/c1-11-5-4-6-12(2)9-15(17)14(8-7-11)13(3)10-16/h6-7,16H,4-5,8-10H2,1-3H3/b11-7-,12-6-,14-13+
Standard InCHIKey	OYONKNQJEXRUQZ-UQIMPMPUSA-N
External Identifiers	ChEMBL [N/A]; PubChem [24836955];
Reference of Component-Ingredient Pair	18663560

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6565
Formula: C15H24

Common Name	(Z)-5-Isopropyl-3,8-Dimethyl-1,3A,4,5,6,8A-Hexahydroazulene
IUPAC Name	(3aR,5R,8aR)-3,8-dimethyl-5-propan-2-yl-1,3a,4,5,6,8a-hexahydroazulene
Canonical SMILES	CC([C@@H]1CC=C([C@H]2[C@@H](C1)C(=CC2)C)C)C
Standard InCHI	InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-6,10,13-15H,7-9H2,1-4H3/t13-,14+,15+/m1/s1
Standard InCHIKey	VLYOKOMUXBDNDF-ILXRZTDVSA-N
External Identifiers	ChEMBL [N/A]; PubChem [22216630];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6556
Formula: C15H22O2

Common Name	(S,Z)-6-Methyl-5-(3-Oxobutyl)-2-(Propan-2-Ylidene)Cyclohept-4-Enone
IUPAC Name	(6S)-6-methyl-5-(3-oxobutyl)-2-propan-2-ylidenecyclohept-4-en-1-one
Canonical SMILES	CC(=O)CCC1=CCC(=C(C)C)C(=O)C[C@@H]1C
Standard InCHI	InChI=1S/C15H22O2/c1-10(2)14-8-7-13(6-5-12(4)16)11(3)9-15(14)17/h7,11H,5-6,8-9H2,1-4H3/t11-/m0/s1
Standard InCHIKey	JWUVBGKPYDWLJC-NSHDSACASA-N
External Identifiers	ChEMBL [N/A]; PubChem [21769417];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6344
Formula: C10H18O

Common Name	(1R,2S,5S)-5-Isopropyl-2-Methylbicyclo[3.1.0]Hexan-2-Ol
IUPAC Name	(1R,2S,5S)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hexan-2-ol
Canonical SMILES	CC([C@]12CC[C@]([C@@H]2C1)(C)O)C
Standard InCHI	InChI=1S/C10H18O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h7-8,11H,4-6H2,1-3H3/t8-,9-,10-/m0/s1
Standard InCHIKey	KXSDPILWMGFJMM-GUBZILKMSA-N
External Identifiers	ChEMBL [N/A]; PubChem [20055523];
Reference of Component-Ingredient Pair	12683013

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6262
Formula: C15H24

Common Name	(1R,3Ar,4R,7R,Z)-1,4-Dimethyl-7-(Prop-1-En-2-Yl)-1,2,3,3A,4,5,6,7-Octahydroazulene
IUPAC Name	(1R,3aR,4R,7R)-1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene
Canonical SMILES	C[C@@H]1CC[C@H]2C1=C[C@@H](CC[C@H]2C)C(=C)C
Standard InCHI	InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h9,11-14H,1,5-8H2,2-4H3/t11-,12-,13-,14-/m1/s1
Standard InCHIKey	DUYRYUZIBGFLDD-AAVRWANBSA-N
External Identifiers	ChEMBL [N/A]; PubChem [15560285];
Reference of Component-Ingredient Pair	21299131

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6261
Formula: C15H24

Common Name	(1Ar,7R,7Ar,7Bs)-1,1,7,7A-Tetramethyl-1A,2,3,5,6,7,7A,7B-Octahydro-1H-Cyclopropa[A]Naphthalene,Calarene
IUPAC Name	(1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-2,3,5,6,7,7b-hexahydro-1aH-cyclopropa[a]naphthalene
Canonical SMILES	C[C@@H]1CCC=C2[C@@]1(C)[C@H]1[C@H](C1(C)C)CC2
Standard InCHI	InChI=1S/C15H24/c1-10-6-5-7-11-8-9-12-13(14(12,2)3)15(10,11)4/h7,10,12-13H,5-6,8-9H2,1-4H3/t10-,12-,13+,15+/m1/s1
Standard InCHIKey	MBIPADCEHSKJDQ-PBOSXPJTSA-N
External Identifiers	ChEMBL [N/A]; PubChem [15560278];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH658	Nardostachys chinensis	Gan Song	甘松
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH2241	Panax quinquefolium	Xi Yang Shen	西洋参

Ingredient ID: TCMC6189
Formula: C15H24O3

Common Name	(3S,3As,8R,8Ar)-3,8-Dihydroxy-3,8-Dimethyl-5-(Propan-2-Ylidene)-Hexahydroazulen-6(1H,2H,7H)-One
IUPAC Name	(3S,3aS,8R,8aR)-3,8-dihydroxy-3,8-dimethyl-5-propan-2-ylidene-1,2,3a,4,7,8a-hexahydroazulen-6-one
Canonical SMILES	CC(=C1C[C@H]2[C@H]([C@](CC1=O)(C)O)CC[C@]2(C)O)C
Standard InCHI	InChI=1S/C15H24O3/c1-9(2)10-7-12-11(5-6-14(12,3)17)15(4,18)8-13(10)16/h11-12,17-18H,5-8H2,1-4H3/t11-,12+,14+,15-/m1/s1
Standard InCHIKey	TXIKNNOOLCGADE-PAPYEOQZSA-N
External Identifiers	ChEMBL [CHEMBL2332427]; PubChem [14632998];
Reference of Component-Ingredient Pair	19398040

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6171
Formula: C15H22O2

Common Name	(3S,3As,8Ar)-3-Hydroxy-3-Methyl-8-Methylene-5-(Propan-2-Ylidene)-Hexahydroazulen-6(1H,2H,7H)-One
IUPAC Name	(3S,3aS,8aR)-3-hydroxy-3-methyl-8-methylidene-5-propan-2-ylidene-2,3a,4,8a-tetrahydro-1H-azulen-6-one
Canonical SMILES	C=C1CC(=O)C(=C(C)C)C[C@H]2[C@H]1CC[C@]2(C)O
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)12-8-13-11(5-6-15(13,4)17)10(3)7-14(12)16/h11,13,17H,3,5-8H2,1-2,4H3/t11-,13-,15-/m0/s1
Standard InCHIKey	ITIGZFMSPAFZAE-WHOFXGATSA-N
External Identifiers	ChEMBL [N/A]; PubChem [14543198];
Reference of Component-Ingredient Pair	18589781

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6135
Formula: C15H24O3

Common Name	(S)-6-((1R,4S,5S)-4,5-Dihydroxy-4-Methylcyclohex-2-Enyl)-2-Methylhept-2-En-4-One
IUPAC Name	(6S)-6-[(1R,4R,5S)-4,5-dihydroxy-4-methylcyclohex-2-en-1-yl]-2-methylhept-2-en-4-one
Canonical SMILES	CC(=CC(=O)C[C@@H]([C@@H]1C=C[C@@]([C@H](C1)O)(C)O)C)C
Standard InCHI	InChI=1S/C15H24O3/c1-10(2)7-13(16)8-11(3)12-5-6-15(4,18)14(17)9-12/h5-7,11-12,14,17-18H,8-9H2,1-4H3/t11-,12+,14-,15+/m0/s1
Standard InCHIKey	QJOWFYQIUZMPRY-MYZSUADSSA-N
External Identifiers	ChEMBL [N/A]; PubChem [14287398];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6115
Formula: C15H22O2

Common Name	(5R,6S,9R)-6-Methyl-3-(Propan-2-Ylidene)-9-(Prop-1-En-2-Yl)-1-Oxaspiro[4.4]Nonan-2-One
IUPAC Name	(5R,6S,9R)-6-methyl-3-propan-2-ylidene-9-prop-1-en-2-yl-1-oxaspiro[4.4]nonan-2-one
Canonical SMILES	CC(=C1C[C@@]2(OC1=O)[C@@H](C)CC[C@@H]2C(=C)C)C
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)12-8-15(17-14(12)16)11(5)6-7-13(15)10(3)4/h11,13H,3,6-8H2,1-2,4-5H3/t11-,13+,15+/m0/s1
Standard InCHIKey	KHOTZHZBHNDKOB-NJZAAPMLSA-N
External Identifiers	ChEMBL [CHEMBL2332434]; PubChem [14191394];
Reference of Component-Ingredient Pair	28625730

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC6083
Formula: C15H24O

Common Name	(1Ar,7S,7As,7Br,Z)-1,1,4,7-Tetramethyl-1A,2,3,5,6,7,7A,7B-Octahydro-1H-Cyclopropa[E]Azulen-7-Ol
IUPAC Name	1,1,4,7-tetramethyl-2,3,5,6,7a,7b-hexahydro-1aH-cyclopropa[h]azulen-7-ol
Canonical SMILES	CC1=C2CCC(C2C2C(CC1)C2(C)C)(C)O
Standard InCHI	InChI=1S/C15H24O/c1-9-5-6-11-13(14(11,2)3)12-10(9)7-8-15(12,4)16/h11-13,16H,5-8H2,1-4H3
Standard InCHIKey	FPRYGNYXOFHMLF-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [14038848];
Reference of Component-Ingredient Pair	28436658

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5992
Formula: C12H22O2

Common Name	1-Heptylcyclobutanecarboxylic Acid
IUPAC Name	1-heptylcyclobutane-1-carboxylic acid
Canonical SMILES	CCCCCCCC1(CCC1)C(=O)[O-]
Standard InCHI	InChI=1S/C12H22O2/c1-2-3-4-5-6-8-12(11(13)14)9-7-10-12/h2-10H2,1H3,(H,13,14)/p-1
Standard InCHIKey	FNNBJMGPODSJON-UHFFFAOYSA-M
External Identifiers	ChEMBL [N/A]; PubChem [13301841];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5915
Formula: C15H24

Common Name	(3R,4R)-1-Isopropyl-4-Methyl-3-(Prop-1-En-2-Yl)-4-Vinylcyclohex-1-Ene
IUPAC Name	(3R,4R)-4-ethenyl-4-methyl-1-propan-2-yl-3-prop-1-en-2-ylcyclohexene
Canonical SMILES	C=C[C@@]1(C)CCC(=C[C@@H]1C(=C)C)C(C)C
Standard InCHI	InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,10-11,14H,1,4,8-9H2,2-3,5-6H3/t14-,15+/m1/s1
Standard InCHIKey	MXDMETWAEGIFOE-CABCVRRESA-N
External Identifiers	ChEMBL [N/A]; PubChem [12309449];
Reference of Component-Ingredient Pair	16617783

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5903
Formula: C15H24

Common Name	(1S,4As,8Ar)-1-Isopropyl-4,7-Dimethyl-1,2,4A,5,6,8A-Hexahydronaphthalene,Α-Muurolene
IUPAC Name	(1S,4aS,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,6,8a-hexahydronaphthalene
Canonical SMILES	CC1=C[C@@H]2[C@H](CC1)C(=CC[C@H]2C(C)C)C
Standard InCHI	InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,9-10,13-15H,5,7-8H2,1-4H3/t13-,14+,15-/m0/s1
Standard InCHIKey	QMAYBMKBYCGXDH-ZNMIVQPWSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12306047];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5899
Formula: C15H20O

Common Name	(5R,6R)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-4,5,6,7-Tetrahydrobenzofuran
IUPAC Name	(5R,6R)-6-ethenyl-3,6-dimethyl-5-prop-1-en-2-yl-5,7-dihydro-4H-1-benzofuran
Canonical SMILES	C=C[C@@]1(C)Cc2occ(c2C[C@@H]1C(=C)C)C
Standard InCHI	InChI=1S/C15H20O/c1-6-15(5)8-14-12(11(4)9-16-14)7-13(15)10(2)3/h6,9,13H,1-2,7-8H2,3-5H3/t13-,15+/m1/s1
Standard InCHIKey	HICAMHOOTMOHPA-HIFRSBDPSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12305301];
Reference of Component-Ingredient Pair	27286338

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5878
Formula: C15H20

Common Name	(S)-1-Isopropyl-4,7-Dimethyl-1,2-Dihydronaphthalene
IUPAC Name	(1S)-4,7-dimethyl-1-propan-2-yl-1,2-dihydronaphthalene
Canonical SMILES	CC([C@@H]1CC=C(c2c1cc(C)cc2)C)C
Standard InCHI	InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5-7,9-10,13H,8H2,1-4H3/t13-/m0/s1
Standard InCHIKey	CUUMXRBKJIDIAY-ZDUSSCGKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12302243];
Reference of Component-Ingredient Pair	24881771

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5810
Formula: C15H24O2

Common Name	(3S,3As,6R,8S,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)Octahydro-6H-3A,6-Epoxyazulen-6-Ol
IUPAC Name	(1S,2S,5S,6S,8R)-2,6-dimethyl-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undecan-8-ol
Canonical SMILES	C[C@H]1C[C@@]2(O)O[C@@]3([C@H]1CC[C@@H]3C)CC2=C(C)C
Standard InCHI	InChI=1S/C15H24O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h10-12,16H,5-8H2,1-4H3/t10-,11-,12-,14-,15+/m0/s1
Standard InCHIKey	NFJQWTOAVBZCBF-ZCRGAIPPSA-N
External Identifiers	ChEMBL [N/A]; PubChem [11831434];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5788
Formula: C15H26O

Common Name	(1S,4R,4Ar,8Ar)-1-Isopropyl-4,7-Dimethyl-1,2,3,4,4A,5,6,8A-Octahydronaphthalen-4A-Ol
IUPAC Name	(1S,4R,4aR,8aR)-4,7-dimethyl-1-propan-2-yl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-4a-ol
Canonical SMILES	CC1=C[C@@H]2[C@](CC1)(O)[C@H](C)CC[C@H]2C(C)C
Standard InCHI	InChI=1S/C15H26O/c1-10(2)13-6-5-12(4)15(16)8-7-11(3)9-14(13)15/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13+,14+,15-/m1/s1
Standard InCHIKey	COGPRPSWSKLKTF-CBBWQLFWSA-N
External Identifiers	ChEMBL [CHEMBL3120655]; PubChem [11770062];
Reference of Component-Ingredient Pair	15709384

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5742
Formula: C15H22O2

Common Name	(1R,10R)-6,10-Dimethyl-3-(Propan-2-Ylidene)-11-Oxabicyclo[8.1.0]Undec-6-En-4-One
IUPAC Name	(1S,6E,10S)-6,10-dimethyl-3-propan-2-ylidene-11-oxabicyclo[8.1.0]undec-6-en-4-one
Canonical SMILES	C/C/1=CCC[C@]2(C)O[C@H]2CC(=C(C)C)C(=O)C1
Standard InCHI	InChI=1S/C15H22O2/c1-10(2)12-9-14-15(4,17-14)7-5-6-11(3)8-13(12)16/h6,14H,5,7-9H2,1-4H3/b11-6+/t14-,15-/m0/s1
Standard InCHIKey	DWGVRYKQVZGSIB-NCKTXVJMSA-N
External Identifiers	ChEMBL [N/A]; PubChem [11637239];
Reference of Component-Ingredient Pair	21287405

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5682
Formula: C10H16O

Common Name	(1R)-1,4-Dimethyl-8-Methylene-2-Oxa-Bicyclo[3.2.1]Octane
IUPAC Name	(1R,4S,5R)-1,4-dimethyl-8-methylidene-2-oxabicyclo[3.2.1]octane
Canonical SMILES	C[C@@H]1CO[C@]2(C(=C)[C@@H]1CC2)C
Standard InCHI	InChI=1S/C10H16O/c1-7-6-11-10(3)5-4-9(7)8(10)2/h7,9H,2,4-6H2,1,3H3/t7-,9-,10-/m1/s1
Standard InCHIKey	MYWZEIPXJWLRJT-SZEHBUNVSA-N
External Identifiers	ChEMBL [N/A]; PubChem [11355587];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5656
Formula: C15H16O

Common Name	(3Az,6Z,8E)-3,8-Dimethyl-5-(Propan-2-Ylidene)Azulen-1(5H)-One
IUPAC Name	3,8-dimethyl-5-propan-2-ylideneazulen-1-one
Canonical SMILES	CC(=C1C=CC(=C2C(=C1)C(=CC2=O)C)C)C
Standard InCHI	InChI=1S/C15H16O/c1-9(2)12-6-5-10(3)15-13(8-12)11(4)7-14(15)16/h5-8H,1-4H3
Standard InCHIKey	BHLYQNMLGRQFKV-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [11264315];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5601
Formula: C15H22O2

Common Name	(3R,3As,6R,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)-1,2,3,4,5,8A-Hexahydro-6H-3A,6-Epoxyazulen-6-Ol
IUPAC Name	(1S,2R,5S,8R)-2,6-dimethyl-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undec-6-en-8-ol
Canonical SMILES	CC(=C1C[C@]23O[C@]1(O)C=C([C@@H]3CC[C@H]2C)C)C
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3/t11-,12+,14+,15-/m1/s1
Standard InCHIKey	ISFMXVMWEWLJGJ-PAPYEOQZSA-N
External Identifiers	ChEMBL [CHEMBL2386509]; PubChem [11128245];
Reference of Component-Ingredient Pair	11767075

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5600
Formula: C15H24

Common Name	(S)-2-Methyl-5-((R)-6-Methylhept-5-En-2-Yl)Cyclohexa-1,3-Diene
IUPAC Name	(5S)-2-methyl-5-[(2R)-6-methylhept-5-en-2-yl]cyclohexa-1,3-diene
Canonical SMILES	CC(=CCC[C@H]([C@@H]1CC=C(C=C1)C)C)C
Standard InCHI	InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-10,14-15H,5,7,11H2,1-4H3/t14-,15+/m1/s1
Standard InCHIKey	KKOXKGNSUHTUBV-CABCVRRESA-N
External Identifiers	ChEMBL [CHEMBL479020]; PubChem [11127403];
Reference of Component-Ingredient Pair	23272109

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5599
Formula: C15H24

Common Name	(2S,4Ar)-1,1,5,5-Tetramethyl-1,3,4,5,6,7-Hexahydro-2H-2,4A-Methanonaphthalene,58924 Fluka,Isolongifolene
IUPAC Name	(1R,8S)-2,2,7,7-tetramethyltricyclo[6.2.1.01,6]undec-5-ene
Canonical SMILES	CC1(C)[C@H]2CC[C@@]3(C1=CCCC3(C)C)C2
Standard InCHI	InChI=1S/C15H24/c1-13(2)8-5-6-12-14(3,4)11-7-9-15(12,13)10-11/h6,11H,5,7-10H2,1-4H3/t11-,15-/m0/s1
Standard InCHIKey	CQUAYTJDLQBXCQ-NHYWBVRUSA-N
External Identifiers	ChEMBL [CHEMBL3183415]; PubChem [11127402];
Reference of Component-Ingredient Pair	22653567

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子

Ingredient ID: TCMC5543
Formula: C15H22O

Common Name	(4S,5S)-5-Methyl-4-(Prop-1-En-2-Yl)-2-(Propan-2-Ylidene)-5-Vinylcyclohexanone
IUPAC Name	(4S,5S)-5-ethenyl-5-methyl-2-propan-2-ylidene-4-prop-1-en-2-ylcyclohexan-1-one
Canonical SMILES	C=C[C@]1(C)CC(=O)C(=C(C)C)C[C@H]1C(=C)C
Standard InCHI	InChI=1S/C15H22O/c1-7-15(6)9-14(16)12(10(2)3)8-13(15)11(4)5/h7,13H,1,4,8-9H2,2-3,5-6H3/t13-,15+/m0/s1
Standard InCHIKey	ABLPGPHZENVRRH-DZGCQCFKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10955018];
Reference of Component-Ingredient Pair	24005020

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5499
Formula: C15H24

Common Name	(2R,4Ar,8Ar)-4A,8-Dimethyl-2-(Prop-1-En-2-Yl)-1,2,3,4,4A,5,6,8A-Octahydronaphthalene
IUPAC Name	(3R,4aR,8aR)-5,8a-dimethyl-3-prop-1-en-2-yl-2,3,4,4a,7,8-hexahydro-1H-naphthalene
Canonical SMILES	CC1=CCC[C@]2([C@H]1C[C@@H](CC2)C(=C)C)C
Standard InCHI	InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1
Standard InCHIKey	OZQAPQSEYFAMCY-QLFBSQMISA-N
External Identifiers	ChEMBL [N/A]; PubChem [10856614];
Reference of Component-Ingredient Pair	22224299

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5487
Formula: C17H28O3

Common Name	(1S,3R,6R,7R)-1-Methyl-7-(2-(2-Methyl-1,3-Dioxolan-2-Yl)Ethyl)-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-Ol
IUPAC Name	(1S,3R,6R,7R)-1-methyl-7-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-4-propan-2-ylidenebicyclo[4.1.0]heptan-3-ol
Canonical SMILES	CC(=C1C[C@@H]2[C@H]([C@@]2(C[C@H]1O)C)CCC1(C)OCCO1)C
Standard InCHI	InChI=1S/C17H28O3/c1-11(2)12-9-14-13(16(14,3)10-15(12)18)5-6-17(4)19-7-8-20-17/h13-15,18H,5-10H2,1-4H3/t13-,14-,15-,16+/m1/s1
Standard InCHIKey	FGTOUYKVTMCWLV-FPCVCCKLSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10802724];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5440
Formula: C15H24O2

Common Name	4-((1S,6R,7R)-4-(2-Hydroxypropan-2-Yl)-1-Methylbicyclo[4.1.0]Hept-3-En-7-Yl)Butan-2-One
IUPAC Name	4-[(1S,6R,7R)-4-(2-hydroxypropan-2-yl)-1-methyl-7-bicyclo[4.1.0]hept-3-enyl]butan-2-one
Canonical SMILES	CC(=O)CC[C@@H]1[C@@H]2[C@@]1(C)CC=C(C2)C(O)(C)C
Standard InCHI	InChI=1S/C15H24O2/c1-10(16)5-6-12-13-9-11(14(2,3)17)7-8-15(12,13)4/h7,12-13,17H,5-6,8-9H2,1-4H3/t12-,13-,15+/m1/s1
Standard InCHIKey	BVZWXYNVKRHALI-NFAWXSAZSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10537804];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5400
Formula: C15H22O2

Common Name	(S)-6,10-Dimethyl-3-(Propan-2-Ylidene)Cyclodec-6-Ene-1,4-Dione,Dehydrocurdione
IUPAC Name	(6E,10S)-6,10-dimethyl-3-propan-2-ylidenecyclodec-6-ene-1,4-dione
Canonical SMILES	C/C/1=CCC[C@H](C)C(=O)CC(=C(C)C)C(=O)C1
Standard InCHI	InChI=1S/C15H22O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,12H,5,7-9H2,1-4H3/b11-6+/t12-/m0/s1
Standard InCHIKey	ZYPUZCWWTYIGFV-BCMYLCSRSA-N
External Identifiers	ChEMBL [CHEMBL113997]; PubChem [10421549];
Reference of Component-Ingredient Pair	18663560

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1063	Curcuma longa	Jiang Huang	姜黄

Ingredient ID: TCMC5345
Formula: C15H22O3

Common Name	(3S,3As,5S,8As)-3A-Hydroxy-3,3',3',8-Tetramethyl-1,2,3,3A,4,8A-Hexahydro-6H-Spiro[Azulene-5,2'-Oxiran]-6-One
IUPAC Name	(1S,3aS,7S,8aS)-8a-hydroxy-1,3',3',4-tetramethylspiro[2,3,3a,8-tetrahydro-1H-azulene-7,2'-oxirane]-6-one
Canonical SMILES	CC1=CC(=O)[C@@]2(C[C@]3([C@H]1CC[C@@H]3C)O)OC2(C)C
Standard InCHI	InChI=1S/C15H22O3/c1-9-7-12(16)15(13(3,4)18-15)8-14(17)10(2)5-6-11(9)14/h7,10-11,17H,5-6,8H2,1-4H3/t10-,11-,14-,15+/m0/s1
Standard InCHIKey	QKVASKAIMFWWHV-LWWSYDQCSA-N
External Identifiers	ChEMBL [CHEMBL2332432]; PubChem [10264129];
Reference of Component-Ingredient Pair	20461629

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5344
Formula: C15H22O2

Common Name	(4As,5R,7As)-7A-Methyl-5-(Prop-1-En-2-Yl)-3-(Propan-2-Ylidene)-Hexahydrocyclopenta[B]Pyran-2(3H)-One
IUPAC Name	(4aS,5R,7aS)-7a-methyl-3-propan-2-ylidene-5-prop-1-en-2-yl-4a,5,6,7-tetrahydro-4H-cyclopenta[b]pyran-2-one
Canonical SMILES	CC(=C)[C@@H]1CC[C@]2([C@H]1CC(=C(C)C)C(=O)O2)C
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)11-6-7-15(5)13(11)8-12(10(3)4)14(16)17-15/h11,13H,1,6-8H2,2-5H3/t11-,13-,15-/m0/s1
Standard InCHIKey	ZZEKLJSJUUZCFB-WHOFXGATSA-N
External Identifiers	ChEMBL [CHEMBL2332425]; PubChem [10263441];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5325
Formula: C15H24

Common Name	(S)-1-Methyl-4-(6-Methylhepta-1,5-Dien-2-Yl)Cyclohex-1-Ene,Β-Bisabolene
IUPAC Name	(4S)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
Canonical SMILES	CC(=CCCC(=C)[C@H]1CCC(=CC1)C)C
Standard InCHI	InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H3/t15-/m1/s1
Standard InCHIKey	XZRVRYFILCSYSP-OAHLLOKOSA-N
External Identifiers	ChEMBL [CHEMBL1077088]; PubChem [10104370];
Reference of Component-Ingredient Pair	15075399

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH517	Angelica pubescens	Du Huo	独活
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH562	Saposhnikovia divaricata	Fang Feng	防风
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2241	Panax quinquefolium	Xi Yang Shen	西洋参

Ingredient ID: TCMC5314
Formula: C15H20O3

Common Name	(4Ar,5R,5As,6As)-3,5A-Dimethyl-5-(3-Oxobutyl)-4,4A,5,5A,6,6A-Hexahydro-2H-Cyclopropa[F][1]Benzofuran-2-One
IUPAC Name	(4aR,5R,5aS,6aS)-3,5a-dimethyl-5-(3-oxobutyl)-4a,5,6,6a-tetrahydro-4H-cyclopropa[f][1]benzofuran-2-one
Canonical SMILES	CC(=O)CC[C@@H]1[C@@H]2[C@@]1(C)C[C@H]1C(=C(C)C(=O)O1)C2
Standard InCHI	InChI=1S/C15H20O3/c1-8(16)4-5-11-12-6-10-9(2)14(17)18-13(10)7-15(11,12)3/h11-13H,4-7H2,1-3H3/t11-,12-,13+,15+/m1/s1
Standard InCHIKey	LWEBVMKVDYHHRS-CXTNEJHOSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10083354];
Reference of Component-Ingredient Pair	11354673

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5304
Formula: C26H30O4

Common Name	(2,4-Dihydroxy-6-Methoxyphenyl)(3-Methyl-2-(3-Methylbut-2-Enyl)-6-Phenylcyclohex-3-Enyl)Methanone
IUPAC Name	(2,4-dihydroxy-6-methoxyphenyl)-[(1R,2S,6R)-3-methyl-2-(3-methylbut-2-enyl)-6-phenylcyclohex-3-en-1-yl]methanone
Canonical SMILES	COc1cc(O)cc(c1C(=O)[C@@H]1[C@H](CC=C(C)C)C(=CC[C@H]1c1ccccc1)C)O
Standard InCHI	InChI=1S/C26H30O4/c1-16(2)10-12-20-17(3)11-13-21(18-8-6-5-7-9-18)24(20)26(29)25-22(28)14-19(27)15-23(25)30-4/h5-11,14-15,20-21,24,27-28H,12-13H2,1-4H3/t20-,21+,24-/m1/s1
Standard InCHIKey	DIHCGASLQARQMP-ZFGGDYGUSA-N
External Identifiers	ChEMBL [CHEMBL398503]; PubChem [10069916];
Reference of Component-Ingredient Pair	15081087

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5288
Formula: C15H22O2

Common Name	(5R,6S,9S)-6-Methyl-3-(Propan-2-Ylidene)-9-(Prop-1-En-2-Yl)-1-Oxaspiro[4.4]Nonan-2-One
IUPAC Name	(5R,6S,9S)-6-methyl-3-propan-2-ylidene-9-prop-1-en-2-yl-1-oxaspiro[4.4]nonan-2-one
Canonical SMILES	CC(=C1C[C@@]2(OC1=O)[C@@H](C)CC[C@H]2C(=C)C)C
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)12-8-15(17-14(12)16)11(5)6-7-13(15)10(3)4/h11,13H,3,6-8H2,1-2,4-5H3/t11-,13-,15+/m0/s1
Standard InCHIKey	KHOTZHZBHNDKOB-CORIIIEPSA-N
External Identifiers	ChEMBL [CHEMBL2332433]; PubChem [10014272];
Reference of Component-Ingredient Pair	22853802

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5279
Formula: C15H20O4

Common Name	(4Ar,5R,5As,6Ar)-6A-Hydroxy-3,5A-Dimethyl-5-(3-Oxobutyl)-4,4A,5,5A,6,6A-Hexahydro-2H-Cyclopropa[F][1]Benzofuran-2-One
IUPAC Name	(4aR,5R,5aS,6aR)-6a-hydroxy-3,5a-dimethyl-5-(3-oxobutyl)-4,4a,5,6-tetrahydrocyclopropa[f][1]benzofuran-2-one
Canonical SMILES	CC(=O)CC[C@@H]1[C@@H]2[C@@]1(C)C[C@@]1(C(=C(C)C(=O)O1)C2)O
Standard InCHI	InChI=1S/C15H20O4/c1-8(16)4-5-10-12-6-11-9(2)13(17)19-15(11,18)7-14(10,12)3/h10,12,18H,4-7H2,1-3H3/t10-,12-,14+,15-/m1/s1
Standard InCHIKey	JZIQIHGNLNKQKF-WAZAZEMKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [9992974];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5267
Formula: C11H18O2

Common Name	4-Hydroxy-3,3,5-Trimethyl-4-Vinylcyclohexanone
IUPAC Name	(1S,4R,6R)-1-ethynyl-2,2,6-trimethylcyclohexane-1,4-diol
Canonical SMILES	C#C[C@]1(O)[C@H](C)C[C@H](CC1(C)C)O
Standard InCHI	InChI=1S/C11H18O2/c1-5-11(13)8(2)6-9(12)7-10(11,3)4/h1,8-9,12-13H,6-7H2,2-4H3/t8-,9-,11+/m1/s1
Standard InCHIKey	TYHHDFDFFCATMH-KKZNHRDASA-N
External Identifiers	ChEMBL [N/A]; PubChem [9964263];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5117
Formula: C15H18O2

Common Name	3,6,10-Trimethyl-7,8-Dihydrocyclodeca[B]Furan-4(11H)-One
IUPAC Name	(5Z,9Z)-3,6,10-trimethyl-8,11-dihydro-7H-cyclodeca[b]furan-4-one
Canonical SMILES	C/C/1=C/C(=O)c2c(C/C(=CCC1)/C)occ2C
Standard InCHI	InChI=1S/C15H18O2/c1-10-5-4-6-11(2)8-14-15(13(16)7-10)12(3)9-17-14/h6-7,9H,4-5,8H2,1-3H3/b10-7-,11-6-
Standard InCHIKey	XVOHELPNOXGRBQ-LXQMTTSMSA-N
External Identifiers	ChEMBL [CHEMBL509404]; PubChem [6442374];
Reference of Component-Ingredient Pair	21069738

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC5116
Formula: C15H24O2

Common Name	(3S,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione,Curdione
IUPAC Name	(3S,6E,10S)-6,10-dimethyl-3-propan-2-ylcyclodec-6-ene-1,4-dione
Canonical SMILES	C/C/1=CCC[C@H](C)C(=O)C[C@H](C(=O)C1)C(C)C
Standard InCHI	InChI=1S/C15H24O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,10,12-13H,5,7-9H2,1-4H3/b11-6+/t12-,13-/m0/s1
Standard InCHIKey	KDPFMRXIVDLQKX-NHFJXKHHSA-N
External Identifiers	ChEMBL [CHEMBL113942]; PubChem [6441391];
Reference of Component-Ingredient Pair	28653926

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH2532	Curcuma aromatica	Yu Jin	郁金

Ingredient ID: TCMC5059
Formula: C15H22O

Common Name	(3E,7Z)-3,7-Dimethyl-10-(Propan-2-Ylidene)Cyclodeca-3,7-Dienone,1-Trans,5-Trans Germacrone
IUPAC Name	(3E,7Z)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one
Canonical SMILES	C/C/1=C/CC(=C(C)C)C(=O)C/C(=C/CC1)/C
Standard InCHI	InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8-,13-7+
Standard InCHIKey	CAULGCQHVOVVRN-CZAVNJROSA-N
External Identifiers	ChEMBL [N/A]; PubChem [6370431];
Reference of Component-Ingredient Pair	29655913

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红

Ingredient ID: TCMC5032
Formula: C10H18O

Common Name	(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Ol,Isoborneol,L-Isoborneol
IUPAC Name	(1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
Canonical SMILES	O[C@@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C
Standard InCHI	InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1
Standard InCHIKey	DTGKSKDOIYIVQL-MRTMQBJTSA-N
External Identifiers	ChEMBL [CHEMBL3560760]; PubChem [6321405];
Reference of Component-Ingredient Pair	21562741

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH183	Dryobalanops aromatica	Bing Pian	冰片
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子

Ingredient ID: TCMC4988
Formula: C15H24O

Common Name	(3Z,7Z)-1,5,5,8-Tetramethyl-12-Oxa-Bicyclo[9.1.0]Dodeca-3,7-Diene
IUPAC Name	(3Z,7E)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
Canonical SMILES	C/C/1=CCC(C)(C)/C=CCC2(C(CC1)O2)C
Standard InCHI	InChI=1S/C15H24O/c1-12-6-7-13-15(4,16-13)10-5-9-14(2,3)11-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/b9-5-,12-8+
Standard InCHIKey	QTGAEXCCAPTGLB-ZYEZJADKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5463721];
Reference of Component-Ingredient Pair	21299136

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4967
Formula: C15H22O

Common Name	2,3,3-Trimethyl-2-(3-Methylbuta-1,3-Dien-1-Yl)-6-Methylenecyclohexanone
IUPAC Name	2,3,3-trimethyl-2-[(1E)-3-methylbuta-1,3-dienyl]-6-methylidenecyclohexan-1-one
Canonical SMILES	CC(=C)/C=C/C1(C)C(=O)C(=C)CCC1(C)C
Standard InCHI	InChI=1S/C15H22O/c1-11(2)7-10-15(6)13(16)12(3)8-9-14(15,4)5/h7,10H,1,3,8-9H2,2,4-6H3/b10-7+
Standard InCHIKey	IXLOWPCQVZCDBT-JXMROGBWSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5373835];
Reference of Component-Ingredient Pair	29142412

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4966
Formula: C12H20

Common Name	(E)-1-Ethylidene-7A-Methyl-Octahydro-1H-Indene
IUPAC Name	(3E)-3-ethylidene-3a-methyl-2,4,5,6,7,7a-hexahydro-1H-indene
Canonical SMILES	C/C=C/1CCC2C1(C)CCCC2
Standard InCHI	InChI=1S/C12H20/c1-3-10-7-8-11-6-4-5-9-12(10,11)2/h3,11H,4-9H2,1-2H3/b10-3+
Standard InCHIKey	PLNRDADPGQMIIQ-XCVCLJGOSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5373026];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4952
Formula: C15H24O

Common Name	(1R,11R)-1,5,5,8-Tetramethyl-12-Oxabicyclo[9.1.0]Dodeca-3,7-Diene
IUPAC Name	(3E,7E)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
Canonical SMILES	C/C/1=CCC(C)(C)/C=C/CC2(C(CC1)O2)C
Standard InCHI	InChI=1S/C15H24O/c1-12-6-7-13-15(4,16-13)10-5-9-14(2,3)11-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/b9-5+,12-8+
Standard InCHIKey	QTGAEXCCAPTGLB-PIHCAMFYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5363694];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4934
Formula: C15H24O

Common Name	(1R,11R)-1,5,9,9-Tetramethyl-12-Oxabicyclo[9.1.0]Dodeca-4,7-Diene
IUPAC Name	(4E,7E)-1,5,9,9-tetramethyl-12-oxabicyclo[9.1.0]dodeca-4,7-diene
Canonical SMILES	C/C/1=CCCC2(C)OC2CC(/C=C/C1)(C)C
Standard InCHI	InChI=1S/C15H24O/c1-12-7-5-9-14(2,3)11-13-15(4,16-13)10-6-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/b9-5+,12-8+
Standard InCHIKey	RKQDKXOBRXTSFS-PIHCAMFYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5352470];
Reference of Component-Ingredient Pair	21299131

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4615
Formula: C15H24O

Common Name	(3Z,7Z)-3,7,10,10-Tetramethyl-12-Oxa-Bicyclo[9.1.0]Dodeca-3,7-Diene
IUPAC Name	(3E,7E)-3,7,10,10-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
Canonical SMILES	C/C/1=CCC(C)(C)C2OC2C/C(=C/CC1)/C
Standard InCHI	InChI=1S/C15H24O/c1-11-6-5-7-12(2)10-13-14(16-13)15(3,4)9-8-11/h7-8,13-14H,5-6,9-10H2,1-4H3/b11-8+,12-7+
Standard InCHIKey	WSIKWSKUPSHZMF-NFLJZBCPSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5318105];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4613
Formula: C15H24

Common Name	(1Z,4E,8Z)-2,6,6,9-Tetramethylcycloundeca-1,4,8-Triene
IUPAC Name	(1Z,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Canonical SMILES	C/C/1=CCC(C)(C)/C=C/C/C(=CCC1)/C
Standard InCHI	InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7-,14-10+
Standard InCHIKey	FAMPSKZZVDUYOS-FNXNKRODSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5318101];
Reference of Component-Ingredient Pair	29248443

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4539
Formula: C15H18O2

Common Name	(5R,6S)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-6,7-Dihydrobenzofuran-4(5H)-One
IUPAC Name	(5R,6S)-6-ethenyl-3,6-dimethyl-5-prop-1-en-2-yl-5,7-dihydro-1-benzofuran-4-one
Canonical SMILES	C=C[C@]1(C)Cc2occ(c2C(=O)[C@@H]1C(=C)C)C
Standard InCHI	InChI=1S/C15H18O2/c1-6-15(5)7-11-12(10(4)8-17-11)14(16)13(15)9(2)3/h6,8,13H,1-2,7H2,3-5H3/t13-,15+/m0/s1
Standard InCHIKey	ZVMJXSJCBLRAPD-DZGCQCFKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5317062];
Reference of Component-Ingredient Pair	21433157

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4338
Formula: C15H24

Common Name	7,11-Dimethyl-3-Methylenedodeca-1,6,10-Triene,Β-Farnesene
IUPAC Name	(6E)-7,11-dimethyl-3-methylidenedodeca-1,6,10-triene
Canonical SMILES	C=CC(=C)CC/C=C(/CCC=C(C)C)C
Standard InCHI	InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+
Standard InCHIKey	JSNRRGGBADWTMC-NTCAYCPXSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5281517];
Reference of Component-Ingredient Pair	9442047

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子

Ingredient ID: TCMC4337
Formula: C15H24

Common Name	(E,E)-Α-Farnesene,3,7,11-Trimethyldodeca-1,3,6,10-Tetraene,Farnesene,Α-Farnesene
IUPAC Name	(3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene
Canonical SMILES	C=C/C(=C/C/C=C(/CCC=C(C)C)C)/C
Standard InCHI	InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10+,15-12+
Standard InCHIKey	CXENHBSYCFFKJS-VDQVFBMKSA-N
External Identifiers	ChEMBL [CHEMBL3182226]; PubChem [5281516];
Reference of Component-Ingredient Pair	20044567

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH2725	Fructus perillae	Zi Su Zi	紫苏子

Ingredient ID: TCMC4336
Formula: C15H24

Common Name	(1R,9S)-4,11,11-Trimethyl-8-Methylenebicyclo[7.2.0]Undec-4-Ene,Caryophellene,Β-Caryophyllene
IUPAC Name	(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Canonical SMILES	C/C/1=CCCC(=C)[C@@H]2[C@@H](CC1)C(C2)(C)C
Standard InCHI	InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6+/t13-,14-/m1/s1
Standard InCHIKey	NPNUFJAVOOONJE-GFUGXAQUSA-N
External Identifiers	ChEMBL [CHEMBL445740]; PubChem [5281515];
Reference of Component-Ingredient Pair	22945026

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH224	Thuja orientalis	Ce Bai Ye	侧柏叶
TCMH211	Atractylodes lancea	Cang Zhu	苍术
TCMH144	Herba artemisiae anomalae	Bei Liu Ji Nu	北刘寄奴
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH183	Dryobalanops aromatica	Bing Pian	冰片
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH1141	Schizonepeta tenuifolia	Jing Jie	荆芥
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH1768	Panax notoginseng	San Qi	三七
TCMH1681	Artemisia carvifolia	Qing Hao	青蒿
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH2725	Fructus perillae	Zi Su Zi	紫苏子
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2241	Panax quinquefolium	Xi Yang Shen	西洋参

Ingredient ID: TCMC4221
Formula: C15H18O2

Common Name	(5R,6R)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-6,7-Dihydrobenzofuran-4(5H)-One
IUPAC Name	(5R,6R)-6-ethenyl-3,6-dimethyl-5-prop-1-en-2-yl-5,7-dihydro-1-benzofuran-4-one
Canonical SMILES	C=C[C@@]1(C)Cc2occ(c2C(=O)[C@@H]1C(=C)C)C
Standard InCHI	InChI=1S/C15H18O2/c1-6-15(5)7-11-12(10(4)8-17-11)14(16)13(15)9(2)3/h6,8,13H,1-2,7H2,3-5H3/t13-,15-/m0/s1
Standard InCHIKey	ZVMJXSJCBLRAPD-ZFWWWQNUSA-N
External Identifiers	ChEMBL [N/A]; PubChem [3081930];
Reference of Component-Ingredient Pair	25044589

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4178
Formula: C15H24O

Common Name	(-)-Caryophyllene Oxide,(1R,4R,6R,10S)-4,12,12-Trimethyl-9-Methylidene-5-Oxatricyclo[8.2.0.0~4,6~]Dodecane
IUPAC Name	(1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane
Canonical SMILES	C=C1CC[C@H]2O[C@@]2(CC[C@@H]2[C@@H]1CC2(C)C)C
Standard InCHI	InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1
Standard InCHIKey	NVEQFIOZRFFVFW-RGCMKSIDSA-N
External Identifiers	ChEMBL [CHEMBL508894]; PubChem [1742210];
Reference of Component-Ingredient Pair	28344896

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1368	Apocyni veneti folium	Luo Bu Ma Ye	罗布麻叶
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香
TCMH1503	Eclipta prostrata	Mo Han Lian	墨旱莲

Ingredient ID: TCMC4099
Formula: C11H10

Common Name	(5Z,8Z)-7H-Benzo[7]Annulene
IUPAC Name	7H-benzo[7]annulene
Canonical SMILES	C1=Cc2ccccc2C=CC1
Standard InCHI	InChI=1S/C11H10/c1-2-6-10-8-4-5-9-11(10)7-3-1/h2-9H,1H2
Standard InCHIKey	AATMCCVYMZDTCD-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [637504];
Reference of Component-Ingredient Pair	12467426

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4068
Formula: C15H20O

Common Name	3,6,10-Trimethyl-4,7,8,11-Tetrahydrocyclodeca[B]Furan
IUPAC Name	(5E,9E)-3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan
Canonical SMILES	C/C/1=CCc2c(C/C(=C/CC1)/C)occ2C
Standard InCHI	InChI=1S/C15H20O/c1-11-5-4-6-12(2)9-15-14(8-7-11)13(3)10-16-15/h6-7,10H,4-5,8-9H2,1-3H3/b11-7+,12-6+
Standard InCHIKey	VMDXHYHOJPKFEK-IAVOFVOCSA-N
External Identifiers	ChEMBL [CHEMBL324514]; PubChem [636458];
Reference of Component-Ingredient Pair	26304411

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4037
Formula: C10H22O

Common Name	2,4-Dimethyloctan-4-Ol
IUPAC Name	2,4-dimethyloctan-4-ol
Canonical SMILES	CCCCC(CC(C)C)(O)C
Standard InCHI	InChI=1S/C10H22O/c1-5-6-7-10(4,11)8-9(2)3/h9,11H,5-8H2,1-4H3
Standard InCHIKey	VRFMFHBPJUSGFK-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [568123];
Reference of Component-Ingredient Pair	28718057

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4035
Formula: C10H16

Common Name	1,2,3,4,4A,5,6,8A-Octahydronaphthalene
IUPAC Name	1,2,3,4,4a,5,6,8a-octahydronaphthalene
Canonical SMILES	C1CCC2C(C1)C=CCC2
Standard InCHI	InChI=1S/C10H16/c1-2-6-10-8-4-3-7-9(10)5-1/h1,5,9-10H,2-4,6-8H2
Standard InCHIKey	FYHNWJNOEQBNGO-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [565677];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4034
Formula: C21H34O2

Common Name	(5S,8R,9S,10S,13S,14S)-3-Ethyl-3-Hydroxy-10,13-Dimethyl-Tetradecahydro-2H-Cyclopenta[A]Phenanthren-17(14H)-One
IUPAC Name	3-ethyl-3-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one
Canonical SMILES	CCC1(O)CCC2(C(C1)CCC1C2CCC2(C1CCC2=O)C)C
Standard InCHI	InChI=1S/C21H34O2/c1-4-21(23)12-11-19(2)14(13-21)5-6-15-16-7-8-18(22)20(16,3)10-9-17(15)19/h14-17,23H,4-13H2,1-3H3
Standard InCHIKey	SPKGPDRGORWGNP-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [561925];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4031
Formula: C10H16O

Common Name	5-Isopropyl-2-Methylenecyclohexanone
IUPAC Name	2-methylidene-5-propan-2-ylcyclohexan-1-one
Canonical SMILES	CC(C1CCC(=C)C(=O)C1)C
Standard InCHI	InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h7,9H,3-6H2,1-2H3
Standard InCHIKey	QIHBCMQXRORFNY-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [557612];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4030
Formula: C10H16O2

Common Name	6-(2-Hydroxypropan-2-Yl)-3-Methylcyclohex-2-Enone
IUPAC Name	6-(2-hydroxypropan-2-yl)-3-methylcyclohex-2-en-1-one
Canonical SMILES	CC1=CC(=O)C(CC1)C(O)(C)C
Standard InCHI	InChI=1S/C10H16O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h6,8,12H,4-5H2,1-3H3
Standard InCHIKey	NESBMOKWNSKETJ-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [557484];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4029
Formula: C9H16O

Common Name	Bicyclo[3.3.1]Nonan-2-Ol
IUPAC Name	bicyclo[3.3.1]nonan-2-ol
Canonical SMILES	OC1CCC2CC1CCC2
Standard InCHI	InChI=1S/C9H16O/c10-9-5-4-7-2-1-3-8(9)6-7/h7-10H,1-6H2
Standard InCHIKey	LPHKHFHEUORJNL-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [557157];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4028
Formula: C12H18

Common Name	2,7-Dimethyl-3,6-Dimethyleneocta-1,7-Diene
IUPAC Name	2,7-dimethyl-3,6-dimethylideneocta-1,7-diene
Canonical SMILES	C=C(C(=C)C)CCC(=C)C(=C)C
Standard InCHI	InChI=1S/C12H18/c1-9(2)11(5)7-8-12(6)10(3)4/h1,3,5-8H2,2,4H3
Standard InCHIKey	DNLIDJGQVMJWMU-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [556189];
Reference of Component-Ingredient Pair	21299131

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4016
Formula: C10H18O2

Common Name	5-(3,3-Dimethyloxiran-2-Yl)-3-Methylpent-1-En-3-Ol
IUPAC Name	5-(3,3-dimethyloxiran-2-yl)-3-methylpent-1-en-3-ol
Canonical SMILES	C=CC(CCC1OC1(C)C)(O)C
Standard InCHI	InChI=1S/C10H18O2/c1-5-10(4,11)7-6-8-9(2,3)12-8/h5,8,11H,1,6-7H2,2-4H3
Standard InCHIKey	SATQWIIUJKWZNO-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2228375]; PubChem [529304];
Reference of Component-Ingredient Pair	21922925

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC4009
Formula: C10H18

Common Name	2,6-Dimethylocta-1,7-Diene
IUPAC Name	2,6-dimethylocta-1,7-diene
Canonical SMILES	C=CC(CCCC(=C)C)C
Standard InCHI	InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5,10H,1-2,6-8H2,3-4H3
Standard InCHIKey	YXRZFCBXBJIBAP-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [522313];
Reference of Component-Ingredient Pair	17009001

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3886
Formula: C15H24

Common Name	(4Ar,7R,8As)-4A-Methyl-1-Methylene-7-(Prop-1-En-2-Yl)-Decahydronaphthalene,Β-Selinene
IUPAC Name	(3R,4aS,8aR)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
Canonical SMILES	C=C1CCC[C@]2([C@H]1C[C@@H](CC2)C(=C)C)C
Standard InCHI	InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h13-14H,1,3,5-10H2,2,4H3/t13-,14+,15-/m1/s1
Standard InCHIKey	YOVSPTNQHMDJAG-QLFBSQMISA-N
External Identifiers	ChEMBL [CHEMBL2287242]; PubChem [442393];
Reference of Component-Ingredient Pair	22978233

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香

Ingredient ID: TCMC3882
Formula: C15H24

Common Name	(6R)-3,7,7-Trimethyl-11-Methylidenespiro[5.5]Undec-2-Ene,Β-Chamigrene
IUPAC Name	(6R)-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-ene
Canonical SMILES	CC1=CC[C@@]2(CC1)C(=C)CCCC2(C)C
Standard InCHI	InChI=1S/C15H24/c1-12-7-10-15(11-8-12)13(2)6-5-9-14(15,3)4/h7H,2,5-6,8-11H2,1,3-4H3/t15-/m1/s1
Standard InCHIKey	WLNGPDPILFYWKF-OAHLLOKOSA-N
External Identifiers	ChEMBL [N/A]; PubChem [442353];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH211	Atractylodes lancea	Cang Zhu	苍术
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子

Ingredient ID: TCMC3824
Formula: C10H16

Common Name	(-)-Nopinene,(1S,5S)-6,6-Dimethyl-2-Methylenebicyclo[3.1.1]Heptane,Β-Pinene
IUPAC Name	(1S,5S)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
Canonical SMILES	C=C1CC[C@H]2C[C@@H]1C2(C)C
Standard InCHI	InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1
Standard InCHIKey	WTARULDDTDQWMU-IUCAKERBSA-N
External Identifiers	ChEMBL [CHEMBL3184774]; PubChem [440967];
Reference of Component-Ingredient Pair	23449869

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH1397	Aristolochia debilis	Ma Dou Ling	马兜铃
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2725	Fructus perillae	Zi Su Zi	紫苏子

Ingredient ID: TCMC3756
Formula: C10H14O

Common Name	4,4A,5,6,7,8-Hexahydronaphthalen-2(3H)-One
IUPAC Name	4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-one
Canonical SMILES	O=C1CCC2C(=C1)CCCC2
Standard InCHI	InChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h7-8H,1-6H2
Standard InCHIKey	FOCKPZOFYCTNIA-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [277449];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3663
Formula: C15H24

Common Name	1,5-Dimethyl-8-(Propan-2-Ylidene)Cyclodeca-1,5-Diene
IUPAC Name	1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene
Canonical SMILES	CC1=CCCC(=CCC(=C(C)C)CC1)C
Standard InCHI	InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3
Standard InCHIKey	GXEGJTGWYVZSNR-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [177602];
Reference of Component-Ingredient Pair	US2008124772

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3630
Formula: C15H22O2

Common Name	(3S,3As,6R,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)-1,2,3,4,5,8A-Hexahydro-6H-3A,6-Epoxyazulen-6-Ol
IUPAC Name	(1S,2S,5S,8R)-2,6-dimethyl-9-propan-2-ylidene-11-oxatricyclo[6.2.1.01,5]undec-6-en-8-ol
Canonical SMILES	CC(=C1C[C@]23O[C@]1(O)C=C([C@@H]3CC[C@@H]2C)C)C
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3/t11-,12-,14-,15+/m0/s1
Standard InCHIKey	ISFMXVMWEWLJGJ-NZBPQXDJSA-N
External Identifiers	ChEMBL [N/A]; PubChem [167812];
Reference of Component-Ingredient Pair	29336875

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3586
Formula: C15H26O

Common Name	(1S,4S,4Ar,8Ar)-4-Isopropyl-1,6-Dimethyl-1,2,3,4,4A,7,8,8A-Octahydronaphthalen-1-Ol
IUPAC Name	(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Canonical SMILES	CC1=C[C@@H]2[C@@H](CC1)[C@@](C)(O)CC[C@H]2C(C)C
Standard InCHI	InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14+,15-/m0/s1
Standard InCHIKey	LHYHMMRYTDARSZ-XQLPTFJDSA-N
External Identifiers	ChEMBL [CHEMBL2228955]; PubChem [160799];
Reference of Component-Ingredient Pair	28920347

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3529
Formula: C15H24O2

Common Name	(1S,6R,7R)-7-((S)-3-Hydroxybutyl)-1-Methyl-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-One
IUPAC Name	(1S,6R,7R)-7-[(3S)-3-hydroxybutyl]-1-methyl-4-propan-2-ylidenebicyclo[4.1.0]heptan-3-one
Canonical SMILES	C[C@@H](CC[C@@H]1[C@@H]2[C@@]1(C)CC(=O)C(=C(C)C)C2)O
Standard InCHI	InChI=1S/C15H24O2/c1-9(2)11-7-13-12(6-5-10(3)16)15(13,4)8-14(11)17/h10,12-13,16H,5-8H2,1-4H3/t10-,12+,13+,15-/m0/s1
Standard InCHIKey	OQZCUYXRSFWCJU-ZGFBFQLVSA-N
External Identifiers	ChEMBL [N/A]; PubChem [153942];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3528
Formula: C15H22O2

Common Name	(1S,6R,7R)-1-Methyl-7-(3-Oxobutyl)-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-One
IUPAC Name	(1S,6R,7R)-1-methyl-7-(3-oxobutyl)-4-propan-2-ylidenebicyclo[4.1.0]heptan-3-one
Canonical SMILES	CC(=O)CC[C@@H]1[C@@H]2[C@@]1(C)CC(=O)C(=C(C)C)C2
Standard InCHI	InChI=1S/C15H22O2/c1-9(2)11-7-13-12(6-5-10(3)16)15(13,4)8-14(11)17/h12-13H,5-8H2,1-4H3/t12-,13-,15+/m1/s1
Standard InCHIKey	HUZJLWLCLJEXEL-NFAWXSAZSA-N
External Identifiers	ChEMBL [N/A]; PubChem [153845];
Reference of Component-Ingredient Pair	23160092

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3516
Formula: C19H16O4

Common Name	1,7-Bis(4-Hydroxyphenyl)Hepta-1,6-Diene-3,5-Dione
IUPAC Name	1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Canonical SMILES	O=C(CC(=O)C=Cc1ccc(cc1)O)C=Cc1ccc(cc1)O
Standard InCHI	InChI=1S/C19H16O4/c20-16-7-1-14(2-8-16)5-11-18(22)13-19(23)12-6-15-3-9-17(21)10-4-15/h1-12,20-21H,13H2
Standard InCHIKey	PREBVFJICNPEKM-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [147439];
Reference of Component-Ingredient Pair	21584247

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3510
Formula: C20H18O5

Common Name	1-(4-Hydroxy-3-Methoxyphenyl)-7-(4-Hydroxyphenyl)Hepta-1,6-Diene-3,5-Dione
IUPAC Name	1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Canonical SMILES	COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(cc2)O)ccc1O
Standard InCHI	InChI=1S/C20H18O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-12,21,24H,13H2,1H3
Standard InCHIKey	HJTVQHVGMGKONQ-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [146723];
Reference of Component-Ingredient Pair	21584247

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3319
Formula: C15H22

Common Name	1-Methyl-4-(6-Methylhept-5-En-2-Yl)Benzene
IUPAC Name	1-methyl-4-(6-methylhept-5-en-2-yl)benzene
Canonical SMILES	CC(=CCCC(c1ccc(cc1)C)C)C
Standard InCHI	InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3
Standard InCHIKey	VMYXUZSZMNBRCN-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [92139];
Reference of Component-Ingredient Pair	21162008

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3283
Formula: C10H16

Common Name	(1R)-2,6,6-Trimethylbicyclo[3.1.1]Hept-2-Ene
IUPAC Name	(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
Canonical SMILES	CC1=CC[C@@H]2C[C@H]1C2(C)C
Standard InCHI	InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1
Standard InCHIKey	GRWFGVWFFZKLTI-RKDXNWHRSA-N
External Identifiers	ChEMBL [CHEMBL1236329]; PubChem [82227];
Reference of Component-Ingredient Pair	22945026

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香

Ingredient ID: TCMC3277
Formula: C10H16

Common Name	3,7,7-Trimethylbicyclo[4.1.0]Hept-2-Ene
IUPAC Name	3,7,7-trimethylbicyclo[4.1.0]hept-2-ene
Canonical SMILES	CC1=CC2C(CC1)C2(C)C
Standard InCHI	InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h6,8-9H,4-5H2,1-3H3
Standard InCHIKey	IBVJWOMJGCHRRW-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2286984]; PubChem [79044];
Reference of Component-Ingredient Pair	19696732

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3275
Formula: C10H16

Common Name	1,7,7-Trimethyltricyclo[2.2.1.0~2,6~]Heptane,Tricyclene
IUPAC Name	1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
Canonical SMILES	CC12C3C1CC(C2(C)C)C3
Standard InCHI	InChI=1S/C10H16/c1-9(2)6-4-7-8(5-6)10(7,9)3/h6-8H,4-5H2,1-3H3
Standard InCHIKey	RRBYUSWBLVXTQN-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [79035];
Reference of Component-Ingredient Pair	21936887

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3260
Formula: C12H14O3

Common Name	Ethyl 3-(4-Methoxyphenyl)Acrylate
IUPAC Name	ethyl 3-(4-methoxyphenyl)prop-2-enoate
Canonical SMILES	CCOC(=O)C=Cc1ccc(cc1)OC
Standard InCHI	InChI=1S/C12H14O3/c1-3-15-12(13)9-6-10-4-7-11(14-2)8-5-10/h4-9H,3H2,1-2H3
Standard InCHIKey	DHNGCHLFKUPGPX-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [74728];
Reference of Component-Ingredient Pair	16360934

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3222
Formula: C10H14O

Common Name	3-(4-Methylpent-3-Enyl)Furan,Perillene
IUPAC Name	3-(4-methylpent-3-enyl)furan
Canonical SMILES	CC(=CCCc1cocc1)C
Standard InCHI	InChI=1S/C10H14O/c1-9(2)4-3-5-10-6-7-11-8-10/h4,6-8H,3,5H2,1-2H3
Standard InCHIKey	XNGKCOFXDHYSGR-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [68316];
Reference of Component-Ingredient Pair	16332132

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH2721	Perilla frutescens var. arguta	Zi Su Geng	紫苏梗
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶

Ingredient ID: TCMC3203
Formula: C10H18O

Common Name	1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Ol,Borneol
IUPAC Name	1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
Canonical SMILES	OC1CC2C(C1(C)CC2)(C)C
Standard InCHI	InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3
Standard InCHIKey	DTGKSKDOIYIVQL-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1097205]; PubChem [64685];
Reference of Component-Ingredient Pair	22740342

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH183	Dryobalanops aromatica	Bing Pian	冰片
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻

Ingredient ID: TCMC3185
Formula: C6H12O

Common Name	Hex-5-En-2-Ol
IUPAC Name	hex-5-en-2-ol
Canonical SMILES	C=CCCC(O)C
Standard InCHI	InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3,6-7H,1,4-5H2,2H3
Standard InCHIKey	LNPNXWKVAFKIBX-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [41170];
Reference of Component-Ingredient Pair	22824894

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3179
Formula: C15H20O2

Common Name	(1As,3As,6As,6Br)-5,5,6B-Trimethyl-1,1A,3A,4,5,6,6A,6B-Octahydrocyclopropa[E]Indene-1A,2-Dicarbaldehyde
IUPAC Name	(1aS,3aS,6aS,6bR)-5,5,6b-trimethyl-3a,4,6,6a-tetrahydro-1H-cyclopropa[e]indene-1a,2-dicarbaldehyde
Canonical SMILES	O=CC1=C[C@@H]2CC(C[C@@H]2[C@@]2([C@@]1(C=O)C2)C)(C)C
Standard InCHI	InChI=1S/C15H20O2/c1-13(2)5-10-4-11(7-16)15(9-17)8-14(15,3)12(10)6-13/h4,7,9-10,12H,5-6,8H2,1-3H3/t10-,12+,14-,15-/m1/s1
Standard InCHIKey	PJAAESPGJOSQGZ-DZGBDDFRSA-N
External Identifiers	ChEMBL [CHEMBL518292]; PubChem [37839];
Reference of Component-Ingredient Pair	24408731

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3150
Formula: C10H16

Common Name	3,7,7-Trimethylbicyclo[4.1.0]Hept-3-Ene,3-Carene
IUPAC Name	3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Canonical SMILES	CC1=CCC2C(C1)C2(C)C
Standard InCHI	InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3
Standard InCHIKey	BQOFWKZOCNGFEC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL506854]; PubChem [26049];
Reference of Component-Ingredient Pair	22888793

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1803	Amomum villosum	Sha Ren	砂仁

Ingredient ID: TCMC3126
Formula: C10H16

Common Name	1-Isopropyl-4-Methylenebicyclo[3.1.0]Hexane,Sabinene
IUPAC Name	4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane
Canonical SMILES	C=C1CCC2(C1C2)C(C)C
Standard InCHI	InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h7,9H,3-6H2,1-2H3
Standard InCHIKey	NDVASEGYNIMXJL-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL452687]; PubChem [18818];
Reference of Component-Ingredient Pair	22953925

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

Ingredient ID: TCMC3125
Formula: C10H16

Common Name	3,7-Dimethylocta-1,3,6-Triene
IUPAC Name	3,7-dimethylocta-1,3,6-triene
Canonical SMILES	C=CC(=CCC=C(C)C)C
Standard InCHI	InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3
Standard InCHIKey	IHPKGUQCSIINRJ-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3187449]; PubChem [18756];
Reference of Component-Ingredient Pair	22518079

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3121
Formula: C10H16

Common Name	5-Isopropyl-2-Methylbicyclo[3.1.0]Hex-2-Ene,Α-Thujene
IUPAC Name	2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene
Canonical SMILES	CC1=CCC2(C1C2)C(C)C
Standard InCHI	InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3
Standard InCHIKey	KQAZVFVOEIRWHN-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [17868];
Reference of Component-Ingredient Pair	22088669

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1835	Kaempferia galanga	Shan Nai	山柰

Ingredient ID: TCMC3109
Formula: C13H14

Common Name	2-Isopropylnaphthalene
IUPAC Name	2-propan-2-ylnaphthalene
Canonical SMILES	CC(c1ccc2c(c1)cccc2)C
Standard InCHI	InChI=1S/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3
Standard InCHIKey	TVYVQNHYIHAJTD-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [16238];
Reference of Component-Ingredient Pair	15376540

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3104
Formula: C11H24O

Common Name	Undecan-2-Ol
IUPAC Name	undecan-2-ol
Canonical SMILES	CCCCCCCCCC(O)C
Standard InCHI	InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11(2)12/h11-12H,3-10H2,1-2H3
Standard InCHIKey	XMUJIPOFTAHSOK-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [15448];
Reference of Component-Ingredient Pair	20512565

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3099
Formula: C10H16

Common Name	6,6-Dimethyl-2-Methylenebicyclo[3.1.1]Heptane,Β-Pinene
IUPAC Name	6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
Canonical SMILES	C=C1CCC2CC1C2(C)C
Standard InCHI	InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3
Standard InCHIKey	WTARULDDTDQWMU-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL501351]; PubChem [14896];
Reference of Component-Ingredient Pair	29191726

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH216	Fructus tsaoko	Cao Guo	草果
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

Ingredient ID: TCMC3082
Formula: C9H18O

Common Name	Nonan-2-One
IUPAC Name	nonan-2-one
Canonical SMILES	CCCCCCCC(=O)C
Standard InCHI	InChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3
Standard InCHIKey	VKCYHJWLYTUGCC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2228473]; PubChem [13187];
Reference of Component-Ingredient Pair	22917765

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1903	Zingiber officinale	Sheng Jiang	生姜

Ingredient ID: TCMC3078
Formula: C10H20O

Common Name	Decan-2-One
IUPAC Name	decan-2-one
Canonical SMILES	CCCCCCCCC(=O)C
Standard InCHI	InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3
Standard InCHIKey	ZAJNGDIORYACQU-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL47127]; PubChem [12741];
Reference of Component-Ingredient Pair	22272243

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3054
Formula: C9H20O

Common Name	Nonan-2-Ol
IUPAC Name	nonan-2-ol
Canonical SMILES	CCCCCCCC(O)C
Standard InCHI	InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3
Standard InCHIKey	NGDNVOAEIVQRFH-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL454517]; PubChem [12367];
Reference of Component-Ingredient Pair	18213499

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC304
Formula: C10H18O

Common Name	2-(4-Methylcyclohex-3-En-1-Yl)Propan-2-Ol
IUPAC Name	2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
Canonical SMILES	CC1=CCC(CC1)C(O)(C)C
Standard InCHI	InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3
Standard InCHIKey	WUOACPNHFRMFPN-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL449810]; PubChem [17100];
Reference of Component-Ingredient Pair	26795242

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH907	Piper nigrum	Hu Jiao	胡椒
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH2407	Bupleurum chinense	Yan Tai Chai Hu	烟台柴胡
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH2580	Coptis chinensis	Ze Xi Huang Lian	择细黄连
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH2144	Inula helenium	Tu Mu Xiang	土木香
TCMH53	Amomum kravanh	Bai Dou Kou	白豆蔻
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH226	Camellia sinensis	Cha Ye	茶叶
TCMH1894	Pinellia ternata	Sheng Ban Xia	生半夏
TCMH151	Rosmarinus officinalis	Bei Wu Wei	北五味
TCMH2462	Crataegus pinnatifida	Ye Shan Zha	野山楂
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH1299	Ganoderma lucidum	Ling Zhi(1)	灵芝
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2322	Prunus armeniaca	Xing Ren	杏仁
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH1660	Senecio scandens	Qian Li Guang	千里光
TCMH2698	Valeriana officinalis	Zhua Di Hu	抓地虎
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH348	Lobelia chinensis	Da Ban Bian Lian	大半边莲
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH132	Scutellaria barbata	Ban Zhi Lian	半枝莲
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2180	Ficus carica	Wu Hua Guo	无花果
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1686	Canarium album	Qing Guo Tan	青果炭
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH737	Crataegus pinnatifida	Guang Shan Zha	广山楂
TCMH1848	Crataegus pinnatifida	Shan Zha	山楂
TCMH1849	Crataegus pinnatifida	Shan Zha Chou Gao	山楂稠膏
TCMH1852	Crataegus pinnatifida	Shan Zha Qing Gao	山楂清膏
TCMH1853	Crataegus pinnatifida	Shan Zha Tan	山楂炭
TCMH122	Lobelia chinensis	Ban Bian Lian	半边莲
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1225	Valeriana officinalis	Kuan Ye Xie Cao	宽叶缬草
TCMH2310	Valeriana officinalis	Xie Cao	缬草
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH131	Pinellia ternata	Ban Xia Qu	半夏曲
TCMH1677	Pinellia ternata	Qing Ban Xia	清半夏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1296	Ganoderma lucidum	Ling Zhi Jin Gao	灵芝浸膏
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH64	Piper nigrum	Bai Hu Jiao	白胡椒
TCMH839	Piper nigrum	Hei Hu Jiao	黑胡椒
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH229	Bupleurum chinense	Chai Hu Jin Gao	柴胡浸膏
TCMH230	Bupleurum chinense	Chai Hu Shao	柴胡梢
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH650	Canarium album	Gan Lan	橄榄
TCMH1683	Canarium album	Qing Guo	青果
TCMH283	Coptis chinensis	Chuan Huang Lian	川黄连
TCMH972	Coptis chinensis	Huang Lian	黄连
TCMH973	Coptis chinensis	Huang Lian Gan Jin Gao	黄连干浸膏
TCMH975	Coptis chinensis	Huang Lian Xu	黄连须
TCMH1064	Coptis chinensis	Jiang Huang Lian	姜黄连
TCMH1161	Coptis chinensis	Jiu Huang Lian	酒黄连
TCMH2330	Coptis chinensis	Xiong Huang Lian	雄黄连
TCMH2531	Coptis chinensis	Yu Huang Lian	萸黄连
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH51	Camellia sinensis	Bai Cha	白茶
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参

Ingredient ID: TCMC3028
Formula: C10H16

Common Name	3-Isopropyl-6-Methylenecyclohex-1-Ene,3-Methylene-6-(1-Methylethyl)-Cyclohexene,Β-Phellandrene
IUPAC Name	3-methylidene-6-propan-2-ylcyclohexene
Canonical SMILES	CC(C1CCC(=C)C=C1)C
Standard InCHI	InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3
Standard InCHIKey	LFJQCDVYDGGFCH-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL444254]; PubChem [11142];
Reference of Component-Ingredient Pair	22978237

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1835	Kaempferia galanga	Shan Nai	山柰

Ingredient ID: TCMC3020
Formula: C10H14

Common Name	M-Cymene
IUPAC Name	1-methyl-3-propan-2-ylbenzene
Canonical SMILES	Cc1cccc(c1)C(C)C
Standard InCHI	InChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h4-8H,1-3H3
Standard InCHIKey	XCYJPXQACVEIOS-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10812];
Reference of Component-Ingredient Pair	22679871

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC3016
Formula: C10H14

Common Name	O-Cymene
IUPAC Name	1-methyl-2-propan-2-ylbenzene
Canonical SMILES	CC(c1ccccc1C)C
Standard InCHI	InChI=1S/C10H14/c1-8(2)10-7-5-4-6-9(10)3/h4-8H,1-3H3
Standard InCHIKey	WWRCMNKATXZARA-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10703];
Reference of Component-Ingredient Pair	22683894

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC2986
Formula: C8H14O

Common Name	6-Methylhept-5-En-2-One,Sulcatone
IUPAC Name	6-methylhept-5-en-2-one
Canonical SMILES	CC(=O)CCC=C(C)C
Standard InCHI	InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3
Standard InCHIKey	UHEPJGULSIKKTP-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL46340]; PubChem [9862];
Reference of Component-Ingredient Pair	22945026

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1368	Apocyni veneti folium	Luo Bu Ma Ye	罗布麻叶

Ingredient ID: TCMC2980
Formula: C6H10O

Common Name	4-Methylpent-3-En-2-One
IUPAC Name	4-methylpent-3-en-2-one
Canonical SMILES	CC(=CC(=O)C)C
Standard InCHI	InChI=1S/C6H10O/c1-5(2)4-6(3)7/h4H,1-3H3
Standard InCHIKey	SHOJXDKTYKFBRD-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3185916]; PubChem [8858];
Reference of Component-Ingredient Pair	21760786

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC2960
Formula: C11H22O

Common Name	Methyl-N-Nonylketone,Undecan-2-One
IUPAC Name	undecan-2-one
Canonical SMILES	CCCCCCCCCC(=O)C
Standard InCHI	InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3
Standard InCHIKey	KYWIYKKSMDLRDC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1236582]; PubChem [8163];
Reference of Component-Ingredient Pair	22477025

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草

Ingredient ID: TCMC295
Formula: C18H22O2

Common Name	2-(2-Phenylpropan-2-Ylperoxy)Propan-2-Ylbenzene
IUPAC Name	2-(2-phenylpropan-2-ylperoxy)propan-2-ylbenzene
Canonical SMILES	CC(c1ccccc1)(OOC(c1ccccc1)(C)C)C
Standard InCHI	InChI=1S/C18H22O2/c1-17(2,15-11-7-5-8-12-15)19-20-18(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3
Standard InCHIKey	XMNIXWIUMCBBBL-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1519055]; PubChem [6641];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术

Ingredient ID: TCMC2937
Formula: C11H12O2

Common Name	Ethyl 3-Phenylacrylate
IUPAC Name	ethyl 3-phenylprop-2-enoate
Canonical SMILES	CCOC(=O)C=Cc1ccccc1
Standard InCHI	InChI=1S/C11H12O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3
Standard InCHIKey	KBEBGUQPQBELIU-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3182745]; PubChem [7649];
Reference of Component-Ingredient Pair	20491085

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC2932
Formula: C10H14

Common Name	P-Cymol,P-Cymene,Umbelliferone
IUPAC Name	1-methyl-4-propan-2-ylbenzene
Canonical SMILES	Cc1ccc(cc1)C(C)C
Standard InCHI	InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
Standard InCHIKey	HFPZCAJZSCWRBC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL442915]; PubChem [7463];
Reference of Component-Ingredient Pair	29191726

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH502	Rabdosia rubescens	Dong Ling Cao	冬凌草
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH517	Angelica pubescens	Du Huo	独活
TCMH216	Fructus tsaoko	Cao Guo	草果
TCMH1141	Schizonepeta tenuifolia	Jing Jie	荆芥
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1609	Eupatorium fortunei	Pei Lan	佩兰
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2640	Valeriana jatamansii	Zhi Zhu Xiang	蜘蛛香
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH1695	Pericarpium citri reticulatae viride	Qing Pi	青皮
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

Ingredient ID: TCMC2931
Formula: C10H16

Common Name	1-Isopropyl-4-Methylcyclohexa-1,3-Diene,Terpilene,Α-Terpinene
IUPAC Name	1-methyl-4-propan-2-ylcyclohexa-1,3-diene
Canonical SMILES	CC1=CC=C(CC1)C(C)C
Standard InCHI	InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8H,5,7H2,1-3H3
Standard InCHIKey	YHQGMYUVUMAZJR-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2251642]; PubChem [7462];
Reference of Component-Ingredient Pair	23030436

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH517	Angelica pubescens	Du Huo	独活
TCMH1368	Apocyni veneti folium	Luo Bu Ma Ye	罗布麻叶
TCMH1005	Cannabis sativa	Huo Ma Ren	火麻仁
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH1695	Pericarpium citri reticulatae viride	Qing Pi	青皮

Ingredient ID: TCMC2930
Formula: C10H16

Common Name	5-Isopropyl-2-Methylcyclohexa-1,3-Diene,Α-Phellandrene
IUPAC Name	2-methyl-5-propan-2-ylcyclohexa-1,3-diene
Canonical SMILES	CC1=CCC(C=C1)C(C)C
Standard InCHI	InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3
Standard InCHIKey	OGLDWXZKYODSOB-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3188459]; PubChem [7460];
Reference of Component-Ingredient Pair	22674887

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

Ingredient ID: TCMC2901
Formula: C10H16

Common Name	2,2-Dimethyl-3-Methylenebicyclo[2.2.1]Heptane,Camphene
IUPAC Name	2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane
Canonical SMILES	C=C1C2CCC(C1(C)C)C2
Standard InCHI	InChI=1S/C10H16/c1-7-8-4-5-9(6-8)10(7,2)3/h8-9H,1,4-6H2,2-3H3
Standard InCHIKey	CRPUJAZIXJMDBK-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL2268550]; PubChem [6616];
Reference of Component-Ingredient Pair	23449869

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

Ingredient ID: TCMC2896
Formula: C12H20O2

Common Name	1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Yl Acetate,Bornyl Acetate
IUPAC Name	(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) acetate
Canonical SMILES	CC(=O)OC1CC2C(C1(C)CC2)(C)C
Standard InCHI	InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3
Standard InCHIKey	KGEKLUUHTZCSIP-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1439452]; PubChem [6448];
Reference of Component-Ingredient Pair	23081929

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2640	Valeriana jatamansii	Zhi Zhu Xiang	蜘蛛香

Ingredient ID: TCMC2882
Formula: C15H22O

Common Name	2,6,9,9-Tetramethylcycloundeca-2,6,10-Trienone
IUPAC Name	2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one
Canonical SMILES	CC1=CCC(C)(C)C=CC(=O)C(=CCC1)C
Standard InCHI	InChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-9,11H,5-6,10H2,1-4H3
Standard InCHIKey	GIHNTRQPEMKFKO-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5725];
Reference of Component-Ingredient Pair	22305785

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC2867
Formula: C21H20O6

Common Name	1,7-Bis(4-Hydroxy-3-Methoxyphenyl)Hepta-1,6-Diene-3,5-Dione
IUPAC Name	1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
Canonical SMILES	COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(c(c2)OC)O)ccc1O
Standard InCHI	InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3
Standard InCHIKey	VFLDPWHFBUODDF-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3187799]; PubChem [2889];
Reference of Component-Ingredient Pair	23122128

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术

Ingredient ID: TCMC2843
Formula: C8H16O

Common Name	Octanal
IUPAC Name	octanal
Canonical SMILES	CCCCCCCC=O
Standard InCHI	InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3
Standard InCHIKey	NUJGJRNETVAIRJ-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL18407]; PubChem [454];
Reference of Component-Ingredient Pair	25014914

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH562	Saposhnikovia divaricata	Fang Feng	防风
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH2618	Citrus aurantium	Zhi Ke	枳壳

Ingredient ID: TCMC2484
Formula: C10H18O

Common Name	Terpineol
IUPAC Name	4-methyl-1-propan-2-ylcyclohex-3-en-1-ol
Canonical SMILES	CC1=CCC(CC1)(O)C(C)C
Standard InCHI	InChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3
Standard InCHIKey	WRYLYDPHFGVWKC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL507795]; PubChem [11230];
Reference of Component-Ingredient Pair	23122094

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH907	Piper nigrum	Hu Jiao	胡椒
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH2144	Inula helenium	Tu Mu Xiang	土木香
TCMH2040	Liquidambar orientalis	Su He Xiang	苏合香
TCMH512	Fructus amomi rotundus	Dou Kou	豆蔻
TCMH307	Cnidium officinale	Chuan Xiong Jin Gao	川芎浸膏
TCMH2491	Alpinia oxyphylla	Yi Zhi Ren	益智仁
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH1894	Pinellia ternata	Sheng Ban Xia	生半夏
TCMH215	Alpinia katsumadai	Cao Dou Kou Ren	草豆蔻仁
TCMH151	Rosmarinus officinalis	Bei Wu Wei	北五味
TCMH308	Dipsacus asperoides	Chuan Xu Duan	川续断
TCMH860	Fructus galangae	Hong Dou Kou	红豆蔻
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH2728	Aster tataricus	Zi Wan	紫菀
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH2698	Valeriana officinalis	Zhua Di Hu	抓地虎
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH961	Artemisia scoparia	Huang Hao	黄蒿
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH2055	Fructus amomi	Suo Sha Ren	缩砂仁
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1225	Valeriana officinalis	Kuan Ye Xie Cao	宽叶缬草
TCMH2310	Valeriana officinalis	Xie Cao	缬草
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH131	Pinellia ternata	Ban Xia Qu	半夏曲
TCMH1677	Pinellia ternata	Qing Ban Xia	清半夏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH2488	Alpinia oxyphylla	Yi Zhi	益智
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH557	Aster tataricus	Fan Hun Cao	返魂草
TCMH939	Aster tataricus	Huai Hun Cao	还魂草
TCMH1490	Aster tataricus	Mi Zi Wan	蜜紫菀
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH64	Piper nigrum	Bai Hu Jiao	白胡椒
TCMH839	Piper nigrum	Hei Hu Jiao	黑胡椒
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH292	Notopterygium incisum	Chuan Qiang Huo	川羌活
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参

Ingredient ID: TCMC2324
Formula: C10H16

Common Name	Limonene
IUPAC Name	(4R)-1-methyl-4-prop-1-en-2-ylcyclohexene
Canonical SMILES	CC1=CC[C@@H](CC1)C(=C)C
Standard InCHI	InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1
Standard InCHIKey	XMGQYMWWDOXHJM-JTQLQIEISA-N
External Identifiers	ChEMBL [CHEMBL449062]; PubChem [440917];
Reference of Component-Ingredient Pair	22945026

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2595	Rhododendron micranthum	Zhao Shan Bai	照山白
TCMH211	Atractylodes lancea	Cang Zhu	苍术
TCMH907	Piper nigrum	Hu Jiao	胡椒
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH2407	Bupleurum chinense	Yan Tai Chai Hu	烟台柴胡
TCMH2039	Caulis perillae frutescentis	Su Geng	苏梗
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH2026	Lignum pini nodi	Song Jie	松节
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH1348	Liquidambar formosana	Lu Lu Tong	路路通
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH123	Pteris semipinnata	Ban Bian Qi	半边旗
TCMH2201	Securidaca inappendiculata	Wu Wei Teng	五味藤
TCMH2144	Inula helenium	Tu Mu Xiang	土木香
TCMH2640	Valeriana jatamansii	Zhi Zhu Xiang	蜘蛛香
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH120	Atractylodes macrocephala	Bai Zhu	白术
TCMH2150	Cuscuta australis	Tu Si Zi Teng	菟丝子藤
TCMH2003	Kyllinga brevifolia	Shui Wu Gong	水蜈蚣
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1141	Schizonepeta tenuifolia	Jing Jie	荆芥
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1336	Pandanus tectorius	Lu Dou	露兜
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH1469	Flos mume	Mei Hua	梅花
TCMH1894	Pinellia ternata	Sheng Ban Xia	生半夏
TCMH1872	Cnidium monnieri	She Ma Zi	蛇麻子
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH428	Codonopsis pilosula	Dang Shen Qing Gao	党参清膏
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH2309	Allium macrostemon	Xie Bai	薤白
TCMH2728	Aster tataricus	Zi Wan	紫菀
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2129	Eupolyphaga sinensis	Tu Bie Chong	土鳖虫
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH2200	Firmiana simplex	Wu Tong Ye Jin Gao	梧桐叶浸膏
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH619	Citrus medica var. sarcodactylis	Fo Shou	佛手
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH2651	Elsholtzia splendens	Zhou Ye Xiang Ru	皱叶香薷
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH2066	Santalum album	Tan Xiang	檀香
TCMH1622	Scutellaria baicalensis	Pian Qin	片芩
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH500	Benincasa hispida	Dong Gua Zi	冬瓜子
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH2101	Eupatorium rebaudianum	Tian Ye Ju	甜叶菊
TCMH502	Rabdosia rubescens	Dong Ling Cao	冬凌草
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH71	Oldenlandia diffusa	Bai Hua She She Cao	白花蛇舌草
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH132	Scutellaria barbata	Ban Zhi Lian	半枝莲
TCMH2216	Evodia rutaecarpa	Wu Zhu Yu	吴茱萸
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2121	Semen astragali complanati	Tong Ji Li	潼蒺藜
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH892	Hericium erinaceus	Hou Tou Jun	猴头菌
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1142	Schizonepetae spica	Jing Jie Sui	荆芥穗
TCMH2213	Ipomoea cairica	Wu Zhao Long	五爪龙
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH1777	Panax notoginseng	San Qi Ye Jing	三七叶茎
TCMH191	Mentha haplocalyx	Bo He You	薄荷油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1810	Semen astragali complanati	Sha Yuan Ji Li	沙苑蒺藜
TCMH1811	Semen astragali complanati	Sha Yuan Zi	沙苑子
TCMH426	Codonopsis pilosula	Dang Shen	党参
TCMH498	Benincasa hispida	Dong Gua Pi	冬瓜皮
TCMH1185	Lycium chinense	Gou Qi	枸杞
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH592	Liquidambar formosana	Feng Xiang Ye	枫香叶
TCMH594	Liquidambar formosana	Feng Xiang Zhi Chou Gao	枫香脂稠膏
TCMH310	Melia azedarach	Chuan Lian	川楝
TCMH1211	Melia azedarach	Ku Lian Pi	苦楝皮
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH131	Pinellia ternata	Ban Xia Qu	半夏曲
TCMH1677	Pinellia ternata	Qing Ban Xia	清半夏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1770	Panax notoginseng	San Qi Gan Jin Gao	三七干浸膏
TCMH1771	Panax notoginseng	San Qi Gao Fen	三七膏粉
TCMH1772	Panax notoginseng	San Qi Hua	三七花
TCMH1774	Panax notoginseng	San Qi Jing Ye	三七茎叶
TCMH1776	Panax notoginseng	San Qi Ye	三七叶
TCMH2276	Elsholtzia splendens	Xiang Ru	香薷
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH2148	Cuscuta australis	Tu Si Rou	菟丝肉
TCMH2149	Cuscuta australis	Tu Si Zi	菟丝子
TCMH557	Aster tataricus	Fan Hun Cao	返魂草
TCMH939	Aster tataricus	Huai Hun Cao	还魂草
TCMH1490	Aster tataricus	Mi Zi Wan	蜜紫菀
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH986	Scutellaria baicalensis	Huang Qin	黄芩
TCMH989	Scutellaria baicalensis	Huang Qin Jin Gao	黄芩浸膏
TCMH990	Scutellaria baicalensis	Huang Qin Jin Gao Fen	黄芩浸膏粉
TCMH992	Scutellaria baicalensis	Huang Qin Tan	黄芩炭
TCMH64	Piper nigrum	Bai Hu Jiao	白胡椒
TCMH839	Piper nigrum	Hei Hu Jiao	黑胡椒
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH229	Bupleurum chinense	Chai Hu Jin Gao	柴胡浸膏
TCMH230	Bupleurum chinense	Chai Hu Shao	柴胡梢
TCMH292	Notopterygium incisum	Chuan Qiang Huo	川羌活
TCMH188	Mentha haplocalyx	Bo He	薄荷
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH2721	Perilla frutescens var. arguta	Zi Su Geng	紫苏梗
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参

Ingredient ID: TCMC2110
Formula: C8H8

Common Name	Styrene
IUPAC Name	styrene
Canonical SMILES	C=Cc1ccccc1
Standard InCHI	InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2
Standard InCHIKey	PPBRXRYQALVLMV-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL285235]; PubChem [7501];
Reference of Component-Ingredient Pair	28951217

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸
TCMH1746	Cinnamomum cassia	Rou Gui Zi	肉桂子
TCMH2040	Liquidambar orientalis	Su He Xiang	苏合香
TCMH317	Capsella bursa-pastoris	Ci Cai	荠菜
TCMH25	Styrax benzoin	An Xi Xiang	安息香
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH2129	Eupolyphaga sinensis	Tu Bie Chong	土鳖虫
TCMH2589	Cinnamomum camphora	Zhang Shu Zi	樟树子
TCMH829	Semen pharbitidis	Hei Chou	黑丑
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH1744	Oleum cinnamomi	Rou Gui Ye	肉桂叶
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH1175	Cornus officinalis	Jiu Yu Rou	酒萸肉
TCMH52	Semen pharbitidis	Bai Chou	白丑
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH716	Cinnamomum cassia	Guan Gui	官桂
TCMH761	Cinnamomum cassia	Gui Zhi	桂枝
TCMH1742	Cinnamomum cassia	Rou Gui	肉桂
TCMH2584	Cinnamomum camphora	Zhang Mu	樟木
TCMH2585	Cinnamomum camphora	Zhang Nao	樟脑
TCMH2587	Cinnamomum camphora	Zhang Nao Zi	樟脑子
TCMH2588	Cinnamomum camphora	Zhang Shu Gen	樟树根

Ingredient ID: TCMC1860
Formula: C10H14O

Common Name	Perillaldehyde
IUPAC Name	4-prop-1-en-2-ylcyclohexene-1-carbaldehyde
Canonical SMILES	O=CC1=CCC(CC1)C(=C)C
Standard InCHI	InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3
Standard InCHIKey	RUMOYJJNUMEFDD-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL469537]; PubChem [16441];
Reference of Component-Ingredient Pair	22489157

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH2303	Pericarpium citri reticulatae viride	Xiao Qing Pi	小青皮
TCMH307	Cnidium officinale	Chuan Xiong Jin Gao	川芎浸膏
TCMH2725	Fructus perillae	Zi Su Zi	紫苏子
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH2723	Oleum folii perillae	Zi Su Ye You	紫苏叶油
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH2047	Fructus perillae	Su Zi	苏子
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH458	Pericarpium citri reticulatae viride	Di Qing Pi	地青皮
TCMH1695	Pericarpium citri reticulatae viride	Qing Pi	青皮
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2721	Perilla frutescens var. arguta	Zi Su Geng	紫苏梗

Ingredient ID: TCMC1839
Formula: C7H6O3

Common Name	Paraben
IUPAC Name	4-oxoniobenzoate
Canonical SMILES	Oc1ccc(cc1)C(=O)O
Standard InCHI	InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
Standard InCHIKey	FJKROLUGYXJWQN-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL441343]; PubChem [3702506];
Reference of Component-Ingredient Pair	8087979

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH600	Euonymus fortunei	Fu Fang Teng	扶芳藤
TCMH334	Allium fistulosum	Cong Bai	葱白
TCMH2563	Polysaccharidum versicolor	Yun Zhi	云芝
TCMH382	Allium sativum	Da Suan	大蒜
TCMH101	Chelidonium majus	Bai Qu Cai	白屈菜
TCMH797	Sargassum	Hai Zao	海藻
TCMH2506	Ginkgo biloba	Yin Xing Ye	银杏叶
TCMH271	Clerodendrum trichotomum	Chou Wu Tong Ye	臭梧桐叶
TCMH1278	Radix zanthoxyli	Liang Mian Zhen	两面针
TCMH123	Pteris semipinnata	Ban Bian Qi	半边旗
TCMH241	Plantago asiatica	Che Qian Zi	车前子
TCMH2513	Rhododendron mucronulatum	Ying Shan Hong	映山红
TCMH1633	Taraxacum mongolicum	Pu Gong Ying Jin Gao	蒲公英浸膏
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH2081	Actinidia arguta	Teng Li Gen	藤梨根
TCMH845	Auricularia auricula-judae	Hei Mu Er	黑木耳
TCMH1740	Cistanche deserticola	Rou Cong Rong	肉苁蓉
TCMH1796	Morus alba	Sang Shen Qing Gao	桑葚清膏
TCMH274	Fritillaria cirrhosa	Chuan Bei Mu Liu Jin Gao	川贝母流浸膏
TCMH1460	Zanthoxylum nitidum	Mao Liang Mian Zhen	毛两面针
TCMH2137	Pogostemon cablin	Tu Huo Xiang	土藿香
TCMH1146	Oryza sativa	Jing Mi	粳米
TCMH1682	Artemisia carvifolia	Qing Hao Zi	青蒿子
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1498	Ranunculus ternatus	Mao Zhao Cao	猫爪草
TCMH561	Senegalia catechu	Fang Er Cha	方儿茶
TCMH25	Styrax benzoin	An Xi Xiang	安息香
TCMH285	Dioscorea nipponica	Chuan Long Shu Yu	穿龙薯蓣
TCMH2515	Papaver somniferum	Ying Su Ke	罂粟壳
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH2436	Elaeagnus pungens	Yang Nai Nai Ye	羊奶奶叶
TCMH571	Paeonia suffruticosa	Fen Dan Pi	粉丹皮
TCMH213	Boschniakia rossica	Cao Cong Rong	草苁蓉
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1105	Trollius chinensis	Jin Lian Hua	金莲花
TCMH748	Euonymus alatus	Gui Jian Yu	鬼箭羽
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH449	Cortex lycii radicis	Di Gu Pi	地骨皮
TCMH700	Drynaria fortunei	Gu Sui Bu	骨碎补
TCMH2462	Crataegus pinnatifida	Ye Shan Zha	野山楂
TCMH800	Herba ecliptae prostratae	Han Lian Cao	旱莲草
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH1299	Ganoderma lucidum	Ling Zhi(1)	灵芝
TCMH860	Fructus galangae	Hong Dou Kou	红豆蔻
TCMH2226	Stigma croci	Xi Hong Hua	西红花
TCMH428	Codonopsis pilosula	Dang Shen Qing Gao	党参清膏
TCMH1322	Solanum nigrum	Long Kui	龙葵
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH1446	Vaccinium oxycoccos	Man Yue Mei	蔓越莓
TCMH1476	Actinidia chinensis	Mi Hou Tao	猕猴桃
TCMH2090	Gastrodia elata	Tian Ma	天麻
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH2232	Scutellaria amoena	Xi Nan Huang Qin	西南黄芩
TCMH2429	Bletilla striata	Yang Jiao Qi	羊角七
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH2740	Trachycarpus fortunei	Zong Lv Zi	棕榈子
TCMH255	Vigna angularis	Chi Dou	赤豆
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH1966	Rehmannia glutinosa	Shu Di Huang	熟地黄
TCMH1798	Morus alba	Sang Zhi	桑枝
TCMH1661	Rhizoma homalomenae occultae	Qian Nian Jian	千年健
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2263	Isodon amethystoides	Xiang Cha Cai	香茶菜
TCMH2113	Herba acalyphae	Tie Xian Cai	铁苋菜
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH1539	Cucurbita moschata	Nan Gua	南瓜
TCMH1766	Sparganium stoloniferum	San Ling	三棱
TCMH1660	Senecio scandens	Qian Li Guang	千里光
TCMH314	Ailanthus altissima	Chun Gen Pi	椿根皮
TCMH2624	Anemarrhena asphodeloides	Zhi Mu	知母
TCMH2356	Daemonorops draco	Xue Xie	血蝎
TCMH2370	Commelina communis	Ya Zhi Cao	鸭跖草
TCMH1483	Tussilago farfara	Mi Kuan Dong Hua	蜜款冬花
TCMH494	Cordyceps sinensis	Dong Chong Xia Cao	冬虫夏草
TCMH1535	Equisetum hiemale	Mu Zei	木贼
TCMH1706	Dianthus superbus	Qu Mai	瞿麦
TCMH1466	Rosa rugosa	Mei Gui Hua	玫瑰花
TCMH348	Lobelia chinensis	Da Ban Bian Lian	大半边莲
TCMH936	Platycarya strobilacea	Hua Xiang Shu Guo Xu	化香树果序
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH2558	Rosa chinensis	Yue Ji Hua	月季花
TCMH906	Viscum coloratum	Hu Ji Sheng	槲寄生
TCMH718	Aristolochia manshuriensis	Guan Mu Tong	关木通
TCMH1305	Laggera alata	Liu Ling Ju	六棱菊
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2135	Glycyrrhiza uralensis	Tu Gan Cao	土甘草
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH72	Bletilla striata	Bai Ji	白芨
TCMH737	Crataegus pinnatifida	Guang Shan Zha	广山楂
TCMH1848	Crataegus pinnatifida	Shan Zha	山楂
TCMH1849	Crataegus pinnatifida	Shan Zha Chou Gao	山楂稠膏
TCMH1852	Crataegus pinnatifida	Shan Zha Qing Gao	山楂清膏
TCMH1853	Crataegus pinnatifida	Shan Zha Tan	山楂炭
TCMH2733	Trachycarpus fortunei	Zong Ban	棕板
TCMH2734	Trachycarpus fortunei	Zong Ban Tan	棕板炭
TCMH2738	Trachycarpus fortunei	Zong Lv Pi	棕榈皮
TCMH273	Fritillaria cirrhosa	Chuan Bei Mu	川贝母
TCMH918	Elaeagnus pungens	Hu Tui Zi Ye	胡颓子叶
TCMH122	Lobelia chinensis	Ban Bian Lian	半边莲
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH426	Codonopsis pilosula	Dang Shen	党参
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH270	Clerodendrum trichotomum	Chou Wu Tong	臭梧桐
TCMH310	Melia azedarach	Chuan Lian	川楝
TCMH1211	Melia azedarach	Ku Lian Pi	苦楝皮
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH1296	Ganoderma lucidum	Ling Zhi Jin Gao	灵芝浸膏
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH978	Taraxacum mongolicum	Huang Miao	黄苗
TCMH1632	Taraxacum mongolicum	Pu Gong Ying	蒲公英
TCMH1681	Artemisia carvifolia	Qing Hao	青蒿
TCMH935	Platycarya strobilacea	Hua Xiang Shu Guo	化香树果
TCMH1792	Morus alba	Sang Pi	桑皮
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶
TCMH519	Pogostemon cablin	Du Huo Xiang	杜藿香
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香
TCMH1008	Pogostemon cablin	Huo Xiang	藿香
TCMH1009	Pogostemon cablin	Huo Xiang Ye	藿香叶
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH61	Ginkgo biloba	Bai Guo Ren	白果仁
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH1223	Tussilago farfara	Kuan Dong Hua	款冬花
TCMH1794	Morus alba	Sang Shen	桑葚
TCMH1795	Morus alba	Sang Shen Jin Gao	桑葚浸膏
TCMH628	Glycyrrhiza uralensis	Gan Cao	甘草
TCMH629	Glycyrrhiza uralensis	Gan Cao Fen	甘草粉
TCMH630	Glycyrrhiza uralensis	Gan Cao Gan Gao	甘草干膏
TCMH631	Glycyrrhiza uralensis	Gan Cao Gan Gao Fen	甘草干膏粉
TCMH632	Glycyrrhiza uralensis	Gan Cao Gan Jin Gao	甘草干浸膏
TCMH633	Glycyrrhiza uralensis	Gan Cao Gao	甘草膏
TCMH634	Glycyrrhiza uralensis	Gan Cao Jie	甘草节
TCMH635	Glycyrrhiza uralensis	Gan Cao Jin Gao	甘草浸膏
TCMH636	Glycyrrhiza uralensis	Gan Cao Liu Jin Gao	甘草流浸膏
TCMH1475	Glycyrrhiza uralensis	Mi Gan Cao	蜜甘草
TCMH1899	Glycyrrhiza uralensis	Sheng Gan Cao	生甘草
TCMH8	Rehmannia glutinosa	Ai Di Huang	矮地黄
TCMH451	Rehmannia glutinosa	Di Huang	地黄
TCMH453	Rehmannia glutinosa	Di Huang Tan	地黄炭
TCMH643	Rehmannia glutinosa	Gan Di Huang	干地黄
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH1489	Papaver somniferum	Mi Ying Su Ke	蜜罂粟壳
TCMH2514	Papaver somniferum	Ying Su	罂粟

Ingredient ID: TCMC1608
Formula: C10H16

Common Name	Myrcene
IUPAC Name	7-methyl-3-methylideneocta-1,6-diene
Canonical SMILES	C=CC(=C)CCC=C(C)C
Standard InCHI	InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
Standard InCHIKey	UAHWPYUMFXYFJY-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL455491]; PubChem [31253];
Reference of Component-Ingredient Pair	22835693

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH4	Ferula assafoetida	A Wei	阿魏
TCMH2595	Rhododendron micranthum	Zhao Shan Bai	照山白
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH593	Resina liquidambaris	Feng Xiang Zhi	枫香脂
TCMH907	Piper nigrum	Hu Jiao	胡椒
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH2407	Bupleurum chinense	Yan Tai Chai Hu	烟台柴胡
TCMH1126	Craibiodendron yunnanese	Jin Ye Zi	金叶子
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH2580	Coptis chinensis	Ze Xi Huang Lian	择细黄连
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH1144	Schizonepetae herba	Jing Jie Tan	荆芥炭
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH123	Pteris semipinnata	Ban Bian Qi	半边旗
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH2303	Pericarpium citri reticulatae viride	Xiao Qing Pi	小青皮
TCMH491	Oleum ocimi gratissimi	Ding Xiang Luo Le You	丁香罗勒油
TCMH307	Cnidium officinale	Chuan Xiong Jin Gao	川芎浸膏
TCMH2244	Prunella vulgaris	Xia Ku Cao	夏枯草
TCMH53	Amomum kravanh	Bai Dou Kou	白豆蔻
TCMH1141	Schizonepeta tenuifolia	Jing Jie	荆芥
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH2050	Punica granatum	Suan Shi Liu	酸石榴
TCMH1609	Eupatorium fortunei	Pei Lan	佩兰
TCMH215	Alpinia katsumadai	Cao Dou Kou Ren	草豆蔻仁
TCMH151	Rosmarinus officinalis	Bei Wu Wei	北五味
TCMH517	Angelica pubescens	Du Huo	独活
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH860	Fructus galangae	Hong Dou Kou	红豆蔻
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH2286	Berberis julianae	Xiao Bo Gen	小檗根
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2129	Eupolyphaga sinensis	Tu Bie Chong	土鳖虫
TCMH1114	Herba glechomae longitubae	Jin Qian Cao	金钱草
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH1615	Eriobotrya japonica	Pi Ba Ren	枇杷仁
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH2651	Elsholtzia splendens	Zhou Ye Xiang Ru	皱叶香薷
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH1396	Portulaca oleracea	Ma Chi Xian	马齿苋
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH2698	Valeriana officinalis	Zhua Di Hu	抓地虎
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH2673	Nepenthes rafflesiana	Zhu Long Cao	猪笼草
TCMH2320	Magnolia liliflora	Xin Yi Ren	辛夷仁
TCMH961	Artemisia scoparia	Huang Hao	黄蒿
TCMH1181	Chrysanthemum morifolium	Ju Hua	菊花
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1179	Citri exocarpium rubrum	Ju Hong	橘红
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH114	Platycladus orientalis	Bai Ye	柏叶
TCMH1970	Pericarpium zanthoxyli	Shu Jiao	蜀椒
TCMH2055	Fructus amomi	Suo Sha Ren	缩砂仁
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1142	Schizonepetae spica	Jing Jie Sui	荆芥穗
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH1777	Panax notoginseng	San Qi Ye Jing	三七叶茎
TCMH191	Mentha haplocalyx	Bo He You	薄荷油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1225	Valeriana officinalis	Kuan Ye Xie Cao	宽叶缬草
TCMH2310	Valeriana officinalis	Xie Cao	缬草
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1943	Punica granatum	Shi Liu	石榴
TCMH1944	Punica granatum	Shi Liu Pi	石榴皮
TCMH1945	Punica granatum	Shi Liu Zi	石榴子
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH1770	Panax notoginseng	San Qi Gan Jin Gao	三七干浸膏
TCMH1771	Panax notoginseng	San Qi Gao Fen	三七膏粉
TCMH1772	Panax notoginseng	San Qi Hua	三七花
TCMH1774	Panax notoginseng	San Qi Jing Ye	三七茎叶
TCMH1776	Panax notoginseng	San Qi Ye	三七叶
TCMH279	Angelica pubescens	Chuan Du Huo	川独活
TCMH2276	Elsholtzia splendens	Xiang Ru	香薷
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH458	Pericarpium citri reticulatae viride	Di Qing Pi	地青皮
TCMH1695	Pericarpium citri reticulatae viride	Qing Pi	青皮
TCMH77	Liquidambar formosana	Bai Jiao Xiang	白胶香
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH64	Piper nigrum	Bai Hu Jiao	白胡椒
TCMH839	Piper nigrum	Hei Hu Jiao	黑胡椒
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH229	Bupleurum chinense	Chai Hu Jin Gao	柴胡浸膏
TCMH230	Bupleurum chinense	Chai Hu Shao	柴胡梢
TCMH292	Notopterygium incisum	Chuan Qiang Huo	川羌活
TCMH809	Chrysanthemum morifolium	Hang Ju	杭菊
TCMH2316	Magnolia liliflora	Xin Yi	辛夷
TCMH2317	Magnolia liliflora	Xin Yi Hua	辛夷花
TCMH2319	Magnolia liliflora	Xin Yi Hua Jin Gao Fen	辛夷花浸膏粉
TCMH188	Mentha haplocalyx	Bo He	薄荷
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH283	Coptis chinensis	Chuan Huang Lian	川黄连
TCMH972	Coptis chinensis	Huang Lian	黄连
TCMH973	Coptis chinensis	Huang Lian Gan Jin Gao	黄连干浸膏
TCMH975	Coptis chinensis	Huang Lian Xu	黄连须
TCMH1064	Coptis chinensis	Jiang Huang Lian	姜黄连
TCMH1161	Coptis chinensis	Jiu Huang Lian	酒黄连
TCMH2330	Coptis chinensis	Xiong Huang Lian	雄黄连
TCMH2531	Coptis chinensis	Yu Huang Lian	萸黄连
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参

Ingredient ID: TCMC1493
Formula: C10H18O

Common Name	Linalool (+)
IUPAC Name	(3R)-3,7-dimethylocta-1,6-dien-3-ol
Canonical SMILES	C=C[C@@](CCC=C(C)C)(O)C
Standard InCHI	InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m0/s1
Standard InCHIKey	CDOSHBSSFJOMGT-JTQLQIEISA-N
External Identifiers	ChEMBL [CHEMBL235672]; PubChem [443158];
Reference of Component-Ingredient Pair	22394400

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH907	Piper nigrum	Hu Jiao	胡椒
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH2407	Bupleurum chinense	Yan Tai Chai Hu	烟台柴胡
TCMH1126	Craibiodendron yunnanese	Jin Ye Zi	金叶子
TCMH2039	Caulis perillae frutescentis	Su Geng	苏梗
TCMH7	Ardisiae japonicae	Ai Di Cha Qing Gao	矮地茶清膏
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH2506	Ginkgo biloba	Yin Xing Ye	银杏叶
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH2166	Clematis chinensis	Wei Ling Xian	威灵仙
TCMH1144	Schizonepetae herba	Jing Jie Tan	荆芥炭
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH953	Aconitum vilmorinianum	Huang Cao Wu	黄草乌
TCMH1165	Murraya paniculata	Jiu Li Xiang	九里香
TCMH2201	Securidaca inappendiculata	Wu Wei Teng	五味藤
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH2144	Inula helenium	Tu Mu Xiang	土木香
TCMH497	Atalantia buxifolia	Dong Feng Ju	东风橘
TCMH2303	Pericarpium citri reticulatae viride	Xiao Qing Pi	小青皮
TCMH491	Oleum ocimi gratissimi	Ding Xiang Luo Le You	丁香罗勒油
TCMH307	Cnidium officinale	Chuan Xiong Jin Gao	川芎浸膏
TCMH2244	Prunella vulgaris	Xia Ku Cao	夏枯草
TCMH316	Ailanthi cortex	Chun Pi	椿皮
TCMH2491	Alpinia oxyphylla	Yi Zhi Ren	益智仁
TCMH2642	Gardenia jasminoides	Zhi Zi Jin Gao	栀子浸膏
TCMH2003	Kyllinga brevifolia	Shui Wu Gong	水蜈蚣
TCMH607	Exodermis poria	Fu Ling Pi	茯苓皮
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH873	Radix et rhizoma rhodiolae	Hong Jing Tian	红景天
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH1609	Eupatorium fortunei	Pei Lan	佩兰
TCMH1894	Pinellia ternata	Sheng Ban Xia	生半夏
TCMH215	Alpinia katsumadai	Cao Dou Kou Ren	草豆蔻仁
TCMH1979	Flos lonicerae	Shuang Hua	双花
TCMH290	Radix cudraniae	Chuan Po Shi	穿破石
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH243	Pericarpium citri reticulatae	Chen Pi	陈皮
TCMH2112	Radix smilacis	Tie Si Wei Ling Xian	铁丝威灵仙
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2322	Prunus armeniaca	Xing Ren	杏仁
TCMH829	Semen pharbitidis	Hei Chou	黑丑
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH670	Ligusticum sinense	Gao Ben	藁本
TCMH2651	Elsholtzia splendens	Zhou Ye Xiang Ru	皱叶香薷
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH1661	Rhizoma homalomenae occultae	Qian Nian Jian	千年健
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH1117	Rhizoma fagopyri cymosi	Jin Qiao Mai	金荞麦
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH2698	Valeriana officinalis	Zhua Di Hu	抓地虎
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH2101	Eupatorium rebaudianum	Tian Ye Ju	甜叶菊
TCMH2320	Magnolia liliflora	Xin Yi Ren	辛夷仁
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1179	Citri exocarpium rubrum	Ju Hong	橘红
TCMH148	Glehnia littoralis	Bei Sha Shen Liu Jin Gao	北沙参流浸膏
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH132	Scutellaria barbata	Ban Zhi Lian	半枝莲
TCMH2558	Rosa chinensis	Yue Ji Hua	月季花
TCMH1970	Pericarpium zanthoxyli	Shu Jiao	蜀椒
TCMH2055	Fructus amomi	Suo Sha Ren	缩砂仁
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH2267	Periploca sepium	Xiang Jia Pi	香加皮
TCMH1029	Paederia scandens	Ji Shi Teng	鸡矢藤
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1184	Citrus reticulata	Ju Pi	橘皮
TCMH2180	Ficus carica	Wu Hua Guo	无花果
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2282	Citrus medica	Xiang Yuan Pi	香橼皮
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH2213	Ipomoea cairica	Wu Zhao Long	五爪龙
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH214	Alpinia katsumadai	Cao Dou Kou	草豆蔻
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH1292	Radix smilacis	Ling Xian	灵仙
TCMH2281	Citrus medica	Xiang Yuan	香橼
TCMH1225	Valeriana officinalis	Kuan Ye Xie Cao	宽叶缬草
TCMH2310	Valeriana officinalis	Xie Cao	缬草
TCMH52	Semen pharbitidis	Bai Chou	白丑
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH131	Pinellia ternata	Ban Xia Qu	半夏曲
TCMH1677	Pinellia ternata	Qing Ban Xia	清半夏
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH2488	Alpinia oxyphylla	Yi Zhi	益智
TCMH2276	Elsholtzia splendens	Xiang Ru	香薷
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1178	Citrus reticulata	Ju He	橘核
TCMH458	Pericarpium citri reticulatae viride	Di Qing Pi	地青皮
TCMH1695	Pericarpium citri reticulatae viride	Qing Pi	青皮
TCMH496	Atalantia buxifolia	Dong Feng Jie	东风桔
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH6	Ardisiae japonicae	Ai Di Cha	矮地茶
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH64	Piper nigrum	Bai Hu Jiao	白胡椒
TCMH839	Piper nigrum	Hei Hu Jiao	黑胡椒
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH229	Bupleurum chinense	Chai Hu Jin Gao	柴胡浸膏
TCMH230	Bupleurum chinense	Chai Hu Shao	柴胡梢
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH61	Ginkgo biloba	Bai Guo Ren	白果仁
TCMH2316	Magnolia liliflora	Xin Yi	辛夷
TCMH2317	Magnolia liliflora	Xin Yi Hua	辛夷花
TCMH2319	Magnolia liliflora	Xin Yi Hua Jin Gao Fen	辛夷花浸膏粉
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH2164	Clematis chinensis	Wei Ling	威灵
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH2721	Perilla frutescens var. arguta	Zi Su Geng	紫苏梗
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏
TCMH147	Glehnia littoralis	Bei Sha Shen	北沙参
TCMH1856	Gardenia jasminoides	Shan Zhi	山栀
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子

Ingredient ID: TCMC1157
Formula: C10H18O

Common Name	Eucalyptol
IUPAC Name	2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane
Canonical SMILES	CC12CCC(CC1)C(O2)(C)C
Standard InCHI	InChI=1S/C10H18O/c1-9(2)8-4-6-10(3,11-9)7-5-8/h8H,4-7H2,1-3H3
Standard InCHIKey	WEEGYLXZBRQIMU-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL485259]; PubChem [2758];
Reference of Component-Ingredient Pair	26795242

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH216	Fructus tsaoko	Cao Guo	草果
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH2039	Caulis perillae frutescentis	Su Geng	苏梗
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH265	Laggera pterodonta	Chu Ling Dan Cao	臭灵丹草
TCMH1753	Boswellia carterii	Ru Xiang	乳香
TCMH2495	Artemisia capillaris	Yin Chen Hao Gan Jin Gao	茵陈蒿干浸膏
TCMH2012	Lycopus lucidus	Shui Ze Lan	水泽兰
TCMH1835	Kaempferia galanga	Shan Nai	山柰
TCMH1693	Aristolochia debilis	Qing Mu Xiang	青木香
TCMH2143	Sophora flavescens	Tu Ku Shen	土苦参
TCMH2144	Inula helenium	Tu Mu Xiang	土木香
TCMH2513	Rhododendron mucronulatum	Ying Shan Hong	映山红
TCMH491	Oleum ocimi gratissimi	Ding Xiang Luo Le You	丁香罗勒油
TCMH2491	Alpinia oxyphylla	Yi Zhi Ren	益智仁
TCMH53	Amomum kravanh	Bai Dou Kou	白豆蔻
TCMH317	Capsella bursa-pastoris	Ci Cai	荠菜
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1374	Ocimum basilicum	Luo Le	罗勒
TCMH1541	Herba artemisiae anomalae	Nan Liu Ji Nu	南刘寄奴
TCMH25	Styrax benzoin	An Xi Xiang	安息香
TCMH2265	Cyperus rotundus	Xiang Fu	香附
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH1825	Litsea cubeba	Shan Jiang Zi	山姜子
TCMH2505	Siphonostegia chinensis	Yin Xing Cao	阴行草
TCMH151	Rosmarinus officinalis	Bei Wu Wei	北五味
TCMH26	Eucalyptus globulus	An Ye	按叶
TCMH108	Perilla frutescens	Bai Su Zi	白苏子
TCMH860	Fructus galangae	Hong Dou Kou	红豆蔻
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH2589	Cinnamomum camphora	Zhang Shu Zi	樟树子
TCMH1393	Verbena officinalis	Ma Bian Cao	马鞭草
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH2284	Ligum cinnamomi camphorae	Xiang Zhang Mu	香樟木
TCMH2551	Polygonatum odoratum	Yu Zhu	玉竹
TCMH2651	Elsholtzia splendens	Zhou Ye Xiang Ru	皱叶香薷
TCMH1486	Ephedra sinica	Mi Ma Huang	蜜麻黄
TCMH1277	Alpinia officinarum	Liang Jiang	良姜
TCMH970	Vitex negundo	Huang Jing Zi	黄荆子
TCMH2532	Curcuma aromatica	Yu Jin	郁金
TCMH2452	Chrysanthemum indicum	Ye Ju Hua	野菊花
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH2698	Valeriana officinalis	Zhua Di Hu	抓地虎
TCMH1903	Zingiber officinale	Sheng Jiang	生姜
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH2320	Magnolia liliflora	Xin Yi Ren	辛夷仁
TCMH961	Artemisia scoparia	Huang Hao	黄蒿
TCMH1181	Chrysanthemum morifolium	Ju Hua	菊花
TCMH2227	Succinus	Xi Hu Po	西琥珀
TCMH502	Rabdosia rubescens	Dong Ling Cao	冬凌草
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH160	Piper cubeba	Bi Cheng Qie	毕澄茄
TCMH658	Nardostachys chinensis	Gan Song	甘松
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH1804	Amomum villosum	Sha Ren Ye	砂仁叶
TCMH1686	Canarium album	Qing Guo Tan	青果炭
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH1846	Artemisia capillaris	Shan Yin Chen	山茵陈
TCMH2154	Artemisia capillaris	Tu Yin Chen Hao	土茵陈蒿
TCMH2494	Artemisia capillaris	Yin Chen Hao	茵陈蒿
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH916	Succinus	Hu Po	琥珀
TCMH144	Herba artemisiae anomalae	Bei Liu Ji Nu	北刘寄奴
TCMH1302	Herba artemisiae anomalae	Liu Ji Nu	刘寄奴
TCMH1225	Valeriana officinalis	Kuan Ye Xie Cao	宽叶缬草
TCMH2310	Valeriana officinalis	Xie Cao	缬草
TCMH1398	Ephedra sinica	Ma Huang	麻黄
TCMH1399	Ephedra sinica	Ma Huang Gao	麻黄膏
TCMH1400	Ephedra sinica	Ma Huang Gen	麻黄根
TCMH1401	Ephedra sinica	Ma Huang Jin Gao	麻黄浸膏
TCMH1215	Sophora flavescens	Ku Shen	苦参
TCMH2080	Sophora flavescens	Teng Ku Shen	藤苦参
TCMH1158	Ocimum basilicum	Jiu Ceng Ta	九层塔
TCMH1290	Ocimum basilicum	Ling Ling Xiang	零陵香
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH1431	Vitex trifolia	Man Jing Ye	蔓荆叶
TCMH2488	Alpinia oxyphylla	Yi Zhi	益智
TCMH2276	Elsholtzia splendens	Xiang Ru	香薷
TCMH672	Alpinia officinarum	Gao Liang Jiang	高良姜
TCMH673	Alpinia officinarum	Gao Liang Jiang You	高良姜油
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
TCMH1397	Aristolochia debilis	Ma Dou Ling	马兜铃
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH264	Laggera pterodonta	Chu Ling Dan	臭灵丹
TCMH511	Litsea cubeba	Dou Chi Jiang	豆豉姜
TCMH1812	Litsea cubeba	Shan Cang Zi	山苍子
TCMH809	Chrysanthemum morifolium	Hang Ju	杭菊
TCMH2316	Magnolia liliflora	Xin Yi	辛夷
TCMH2317	Magnolia liliflora	Xin Yi Hua	辛夷花
TCMH2319	Magnolia liliflora	Xin Yi Hua Jin Gao Fen	辛夷花浸膏粉
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
TCMH650	Canarium album	Gan Lan	橄榄
TCMH1683	Canarium album	Qing Guo	青果
TCMH2584	Cinnamomum camphora	Zhang Mu	樟木
TCMH2585	Cinnamomum camphora	Zhang Nao	樟脑
TCMH2587	Cinnamomum camphora	Zhang Nao Zi	樟脑子
TCMH2588	Cinnamomum camphora	Zhang Shu Gen	樟树根
TCMH253	Citrus aurantium	Cheng Pi	橙皮
TCMH2613	Citrus aurantium	Zhi Geng	枳梗
TCMH2618	Citrus aurantium	Zhi Ke	枳壳
TCMH2619	Citrus aurantium	Zhi Ke Gan Jin Gao	枳壳干浸膏
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏

Ingredient ID: TCMC1031
Formula: C16H22O4

Common Name	Dibutyl Phthalate
IUPAC Name	dibutyl benzene-1,2-dicarboxylate
Canonical SMILES	CCCCOC(=O)c1ccccc1C(=O)OCCCC
Standard InCHI	InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
Standard InCHIKey	DOIRQSBPFJWKBE-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL272485]; PubChem [3026];
Reference of Component-Ingredient Pair	29385629

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸
TCMH457	Euphorbia humifusa	Di Mian Cao	地绵草
TCMH1264	Litchi chinensis	Li Zhi He	荔枝核
TCMH797	Sargassum	Hai Zao	海藻
TCMH2506	Ginkgo biloba	Yin Xing Ye	银杏叶
TCMH2012	Lycopus lucidus	Shui Ze Lan	水泽兰
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH2642	Gardenia jasminoides	Zhi Zi Jin Gao	栀子浸膏
TCMH2137	Pogostemon cablin	Tu Huo Xiang	土藿香
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH422	Angelica sinensis	Dang Gui Gan Jin Gao	当归干浸膏
TCMH1839	Panax ginseng	Shan Shen	山参
TCMH95	Aquilaria sinensis	Bai Mu Xiang	白木香
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH1611	Rhizoma curcumae	Peng E Zhu	蓬莪术
TCMH2206	Schisandra chinensis	Wu Wei Zi Liu Jin Gao	五味子流浸膏
TCMH1483	Tussilago farfara	Mi Kuan Dong Hua	蜜款冬花
TCMH1588	Achyranthes bidentata	Niu Xi	牛膝
TCMH1741	Myristica fragrans	Rou Dou Kou	肉豆蔻
TCMH1437	Rhododendron dauricum	Man Shan Hong	满山红
TCMH2553	Scrophularia ningpoensis	Yuan Shen	元参
TCMH2059	Radix pseudostellariae	Tai Zi Shen	太子参
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2211	Artemisia princeps	Wu Yue Ai	五月艾
TCMH1175	Cornus officinalis	Jiu Yu Rou	酒萸肉
TCMH1584	Achyranthes bidentata	Niu Teng	牛藤
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH544	Curcuma aeruginosa	E Zhu	莪术
TCMH740	Rhizoma curcumae	Guang Xi E Zhu	广西莪术
TCMH368	Herba cirsii japonici	Da Ji Gen	大蓟根
TCMH369	Herba cirsii japonici	Da Ji Gen Jin Gao	大蓟根浸膏
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1728	Panax ginseng	Ren Shen Ye	人参叶
TCMH519	Pogostemon cablin	Du Huo Xiang	杜藿香
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香
TCMH1008	Pogostemon cablin	Huo Xiang	藿香
TCMH1009	Pogostemon cablin	Huo Xiang Ye	藿香叶
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH61	Ginkgo biloba	Bai Guo Ren	白果仁
TCMH814	Nelumbo nucifera	He Geng	荷梗
TCMH825	Nelumbo nucifera	He Ye	荷叶
TCMH1275	Nelumbo nucifera	Lian Zi	莲子
TCMH1276	Nelumbo nucifera	Lian Zi Xin	莲子心
TCMH1598	Nelumbo nucifera	Ou	藕
TCMH1599	Nelumbo nucifera	Ou Fen	藕粉
TCMH1223	Tussilago farfara	Kuan Dong Hua	款冬花
TCMH454	Euphorbia humifusa	Di Jin Cao	地锦草
TCMH2202	Schisandra chinensis	Wu Wei Zi	五味子
TCMH2203	Schisandra chinensis	Wu Wei Zi Chun Jin Gao	五味子醇浸膏
TCMH2204	Schisandra chinensis	Wu Wei Zi Jin Chu Wu	五味子浸出物
TCMH2205	Schisandra chinensis	Wu Wei Zi Jin Gao	五味子浸膏
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏
TCMH1856	Gardenia jasminoides	Shan Zhi	山栀
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子
TCMH2343	Scrophularia ningpoensis	Xuan Shen	玄参

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC295	C18H22O2	2-(2-Phenylpropan-2-Ylperoxy)Propan-2-Ylbenzene	270.16	2.0212	3.22	7.716	2	0	18.46	9	2	20	1
TCMC304	C10H18O	2-(4-Methylcyclohex-3-En-1-Yl)Propan-2-Ol	154.14	1.1223	2.45	2.369	1	1	20.23	5	1	11	0
TCMC948	C9H8O3	Coumaric Acid	164.05	-0.339	2.12	1.886	2	2	57.53	4	1	12	0
TCMC995	C35H60O6	Daucosterol	576.44	-0.4469	4.65	10.487	6	4	99.38	19	5	41	1
TCMC1031	C16H22O4	Dibutyl Phthalate	278.15	-1.2084	2.78	5.034	4	0	52.6	12	1	20	1
TCMC1157	C10H18O	Eucalyptol	154.14	1.3109	2.45	2.595	1	0	9.23	3	0	11	0
TCMC1493	C10H18O	Linalool (+)	154.14	2.4692	2.45	2.468	1	1	20.23	8	0	11	0
TCMC1608	C10H16	Myrcene	136.13	3.0936	2.56	4.17	0	0	0	6	0	10	0
TCMC1839	C7H6O3	Paraben	138.03	-0.7001	1.9	1.07	2	2	57.53	3	1	10	0
TCMC1860	C10H14O	Perillaldehyde	150.1	1.308	2.45	2.355	1	0	17.07	3	1	11	0
TCMC2110	C8H8	Styrene	104.06	0.7075	2.34	4.954	0	0	0	1	1	8	0
TCMC2324	C10H16	Limonene	136.13	2.1424	2.56	3.729	0	0	0	3	1	10	0
TCMC2484	C10H18O	Terpineol	154.14	1.1223	2.45	1.947	1	1	20.23	5	1	11	0
TCMC2843	C8H16O	Octanal	128.1201151	-1.5463	2.23	3.432	1	0	17.07	6	0	9	0
TCMC2867	C21H20O6	1,7-Bis(4-Hydroxy-3-Methoxyphenyl)Hepta-1,6-Diene-3,5-Dione	368.1259884	-0.7948	3.11	2.847	2	2	93.06	8	2	27	0
TCMC2882	C15H22O	2,6,9,9-Tetramethylcycloundeca-2,6,10-Trienone	218.1670653	3.4791	3	4.143	1	0	17.07	0	1	16	0
TCMC2896	C12H20O2	1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Yl Acetate,Bornyl Acetate	196.1463299	1.3223	2.56	3.474	2	0	26.3	2	2	14	0
TCMC2901	C10H16	2,2-Dimethyl-3-Methylenebicyclo[2.2.1]Heptane,Camphene	136.1252005	1.3875	2.56	4.024	0	0	0	0	2	10	0
TCMC2930	C10H16	5-Isopropyl-2-Methylcyclohexa-1,3-Diene,Α-Phellandrene	136.1252005	1.7112	2.56	4.427	0	0	0	1	1	10	0
TCMC2931	C10H16	1-Isopropyl-4-Methylcyclohexa-1,3-Diene,Terpilene,Α-Terpinene	136.1252005	1.8841	2.56	3.546	0	0	0	1	1	10	0
TCMC2932	C10H14	P-Cymol,P-Cymene,Umbelliferone	134.1095504	1.2149	2.56	5.785	0	0	0	1	1	10	1
TCMC2937	C11H12O2	Ethyl 3-Phenylacrylate	176.0837296	0.6227	2.45	4.648	2	0	26.3	4	1	13	0
TCMC2960	C11H22O	Methyl-N-Nonylketone,Undecan-2-One	170.1670653	-2.1838	2.56	4.421	1	0	17.07	8	0	12	0
TCMC2980	C6H10O	4-Methylpent-3-En-2-One	98.07316494	1.1956	2.01	1.06	1	0	17.07	1	0	7	0
TCMC2986	C8H14O	6-Methylhept-5-En-2-One,Sulcatone	126.1044651	1.5927	2.23	1.796	1	0	17.07	3	0	9	0
TCMC3016	C10H14	O-Cymene	134.1095504	1.2149	2.56	5.785	0	0	0	1	1	10	1
TCMC3020	C10H14	M-Cymene	134.1095504	1.2149	2.56	5.785	0	0	0	1	1	10	1
TCMC3028	C10H16	3-Isopropyl-6-Methylenecyclohex-1-Ene,3-Methylene-6-(1-Methylethyl)-Cyclohexene,Β-Phellandrene	136.1252005	1.5645	2.56	4.472	0	0	0	1	1	10	0
TCMC3054	C9H20O	Nonan-2-Ol	144.1514153	-2.1361	2.34	3.587	1	1	20.23	6	0	10	0
TCMC3078	C10H20O	Decan-2-One	156.1514153	-1.8958	2.45	3.852	1	0	17.07	7	0	11	0
TCMC3082	C9H18O	Nonan-2-One	142.1357652	-1.6078	2.34	3.283	1	0	17.07	6	0	10	0
TCMC3099	C10H16	6,6-Dimethyl-2-Methylenebicyclo[3.1.1]Heptane,Β-Pinene	136.1252005	1.3695	2.56	4.222	0	0	0	0	1	10	0
TCMC3104	C11H24O	Undecan-2-Ol	172.1827154	-2.7121	2.56	4.725	1	1	20.23	8	0	12	0
TCMC3109	C13H14	2-Isopropylnaphthalene	170.1095504	0.5729	2.89	7.338	0	0	0	1	2	13	1
TCMC3121	C10H16	5-Isopropyl-2-Methylbicyclo[3.1.0]Hex-2-Ene,Α-Thujene	136.1252005	1.6288	2.56	4.177	0	0	0	1	2	10	0
TCMC3125	C10H16	3,7-Dimethylocta-1,3,6-Triene	136.1252005	3.2403	2.56	4.314	0	0	0	3	0	10	0
TCMC3126	C10H16	1-Isopropyl-4-Methylenebicyclo[3.1.0]Hexane,Sabinene	136.1252005	1.0301	2.56	4.222	0	0	0	1	2	10	0
TCMC3150	C10H16	3,7,7-Trimethylbicyclo[4.1.0]Hept-3-Ene,3-Carene	136.1252005	2.1434	2.56	4.181	0	0	0	0	2	10	0
TCMC3179	C15H20O2	(1As,3As,6As,6Br)-5,5,6B-Trimethyl-1,1A,3A,4,5,6,6A,6B-Octahydrocyclopropa[E]Indene-1A,2-Dicarbaldehyde	232.1463299	1.4622	2.89	4.221	2	0	34.14	2	3	17	0
TCMC3185	C6H12O	Hex-5-En-2-Ol	100.088815	0.2157	2.01	1.514	1	1	20.23	3	0	7	0
TCMC3203	C10H18O	1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Ol,Borneol	154.1357652	0.9432	2.45	2.734	1	1	20.23	0	2	11	0
TCMC3222	C10H14O	3-(4-Methylpent-3-Enyl)Furan,Perillene	150.1044651	1.7201	2.45	3.057	0	0	13.14	3	1	11	0
TCMC3260	C12H14O3	Ethyl 3-(4-Methoxyphenyl)Acrylate	206.0942943	0.5709	2.45	3.149	2	0	35.53	5	1	15	0
TCMC3275	C10H16	1,7,7-Trimethyltricyclo[2.2.1.0~2,6~]Heptane,Tricyclene	136.1252005	0.9365	2.56	4.779	0	0	0	0	1	10	0
TCMC3277	C10H16	3,7,7-Trimethylbicyclo[4.1.0]Hept-2-Ene	136.1252005	1.9812	2.56	4.177	0	0	0	0	2	10	0
TCMC3283	C10H16	(1R)-2,6,6-Trimethylbicyclo[3.1.1]Hept-2-Ene	136.1252005	1.5162	2.56	4.177	0	0	0	0	1	10	0
TCMC3319	C15H22	1-Methyl-4-(6-Methylhept-5-En-2-Yl)Benzene	202.1721507	2.8428	3.11	7.712	0	0	0	4	1	15	1
TCMC3510	C20H18O5	1-(4-Hydroxy-3-Methoxyphenyl)-7-(4-Hydroxyphenyl)Hepta-1,6-Diene-3,5-Dione	338.1154237	-0.743	3.11	3.502	2	2	83.83	7	2	25	0
TCMC3516	C19H16O4	1,7-Bis(4-Hydroxyphenyl)Hepta-1,6-Diene-3,5-Dione	308.104859	-0.6912	3.11	4.157	2	2	74.6	6	2	23	0
TCMC3528	C15H22O2	(1S,6R,7R)-1-Methyl-7-(3-Oxobutyl)-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-One	234.1619799	1.6929	2.89	2.368	2	0	34.14	3	2	17	0
TCMC3529	C15H24O2	(1S,6R,7R)-7-((S)-3-Hydroxybutyl)-1-Methyl-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-One	236.17763	1.1646	2.89	2.672	2	1	37.3	3	2	17	0
TCMC3586	C15H26O	(1S,4S,4Ar,8Ar)-4-Isopropyl-1,6-Dimethyl-1,2,3,4,4A,7,8,8A-Octahydronaphthalen-1-Ol	222.1983655	1.3641	3	4.476	1	1	20.23	1	2	16	0
TCMC3630	C15H22O2	(3S,3As,6R,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)-1,2,3,4,5,8A-Hexahydro-6H-3A,6-Epoxyazulen-6-Ol	234.1619799	2.327	2.89	1.748	2	1	29.46	0	3	17	0
TCMC3663	C15H24	1,5-Dimethyl-8-(Propan-2-Ylidene)Cyclodeca-1,5-Diene	204.1878008	3.953	3.11	5.148	0	0	0	0	1	15	1
TCMC3756	C10H14O	4,4A,5,6,7,8-Hexahydronaphthalen-2(3H)-One	150.1044651	-0.372	2.45	2.065	1	0	17.07	0	2	11	0
TCMC3824	C10H16	(-)-Nopinene,(1S,5S)-6,6-Dimethyl-2-Methylenebicyclo[3.1.1]Heptane,Β-Pinene	136.1252005	1.3695	2.56	4.222	0	0	0	0	1	10	0
TCMC3882	C15H24	(6R)-3,7,7-Trimethyl-11-Methylidenespiro[5.5]Undec-2-Ene,Β-Chamigrene	204.1878008	2.2533	3.11	5.948	0	0	0	0	2	15	1
TCMC3886	C15H24	(4Ar,7R,8As)-4A-Methyl-1-Methylene-7-(Prop-1-En-2-Yl)-Decahydronaphthalene,Β-Selinene	204.1878008	1.7182	3.11	6.19	0	0	0	1	2	15	1
TCMC4009	C10H18	2,6-Dimethylocta-1,7-Diene	138.1408506	2.0248	2.56	4.726	0	0	0	5	0	10	0
TCMC4016	C10H18O2	5-(3,3-Dimethyloxiran-2-Yl)-3-Methylpent-1-En-3-Ol	170.1306798	0.759	2.34	1.559	2	1	32.76	4	1	12	0
TCMC4028	C12H18	2,7-Dimethyl-3,6-Dimethyleneocta-1,7-Diene	162.1408506	3.4564	2.78	4.93	0	0	0	5	0	12	0
TCMC4029	C9H16O	Bicyclo[3.3.1]Nonan-2-Ol	140.1201151	-0.8697	2.34	2.363	1	1	20.23	0	2	10	0
TCMC4030	C10H16O2	6-(2-Hydroxypropan-2-Yl)-3-Methylcyclohex-2-Enone	168.1150298	0.8508	2.34	1.335	2	1	37.3	1	1	12	0
TCMC4031	C10H16O	5-Isopropyl-2-Methylenecyclohexanone	152.1201151	0.8677	2.45	2.617	1	0	17.07	1	1	11	0
TCMC4034	C21H34O2	(5S,8R,9S,10S,13S,14S)-3-Ethyl-3-Hydroxy-10,13-Dimethyl-Tetradecahydro-2H-Cyclopenta[A]Phenanthren-17(14H)-One	318.2558803	0.1179	3.55	5.075	2	1	37.3	1	4	23	1
TCMC4035	C10H16	1,2,3,4,4A,5,6,8A-Octahydronaphthalene	136.1252005	0.302	2.56	4.708	0	0	0	0	2	10	0
TCMC4037	C10H22O	2,4-Dimethyloctan-4-Ol	158.1670653	0.0605	2.45	3.732	1	1	20.23	5	0	11	0
TCMC4068	C15H20O	3,6,10-Trimethyl-4,7,8,11-Tetrahydrocyclodeca[B]Furan	216.1514153	3.2767	3	3.694	0	0	13.14	0	2	16	0
TCMC4099	C11H10	(5Z,8Z)-7H-Benzo[7]Annulene	142.0782503	0.998	2.67	5.964	0	0	0	0	2	11	1
TCMC4178	C15H24O	(-)-Caryophyllene Oxide,(1R,4R,6R,10S)-4,12,12-Trimethyl-9-Methylidene-5-Oxatricyclo[8.2.0.0~4,6~]Dodecane	220.1827154	1.9144	3	4.607	1	0	12.53	0	3	16	0
TCMC4221	C15H18O2	(5R,6R)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-6,7-Dihydrobenzofuran-4(5H)-One	230.1306798	2.5342	2.89	2.829	1	0	30.21	2	2	17	0
TCMC4336	C15H24	(1R,9S)-4,11,11-Trimethyl-8-Methylenebicyclo[7.2.0]Undec-4-Ene,Caryophellene,Β-Caryophyllene	204.1878008	3.2289	3.11	6.044	0	0	0	0	2	15	1
TCMC4337	C15H24	(E,E)-Α-Farnesene,3,7,11-Trimethyldodeca-1,3,6,10-Tetraene,Farnesene,Α-Farnesene	204.1878008	4.4725	3.11	6.136	0	0	0	6	0	15	1
TCMC4338	C15H24	7,11-Dimethyl-3-Methylenedodeca-1,6,10-Triene,Β-Farnesene	204.1878008	4.3258	3.11	5.992	0	0	0	7	0	15	1
TCMC4539	C15H18O2	(5R,6S)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-6,7-Dihydrobenzofuran-4(5H)-One	230.1306798	2.5342	2.89	2.829	1	0	30.21	2	2	17	0
TCMC4613	C15H24	(1Z,4E,8Z)-2,6,6,9-Tetramethylcycloundeca-1,4,8-Triene	204.1878008	4.1708	3.11	5.94	0	0	0	0	1	15	1
TCMC4615	C15H24O	(3Z,7Z)-3,7,10,10-Tetramethyl-12-Oxa-Bicyclo[9.1.0]Dodeca-3,7-Diene	220.1827154	3.1893	3	3.735	1	0	12.53	0	2	16	0
TCMC4934	C15H24O	(1R,11R)-1,5,9,9-Tetramethyl-12-Oxabicyclo[9.1.0]Dodeca-4,7-Diene	220.1827154	3.1411	3	4.503	1	0	12.53	0	2	16	0
TCMC4952	C15H24O	(1R,11R)-1,5,5,8-Tetramethyl-12-Oxabicyclo[9.1.0]Dodeca-3,7-Diene	220.1827154	2.4043	3	4.314	1	0	12.53	0	2	16	0
TCMC4966	C12H20	(E)-1-Ethylidene-7A-Methyl-Octahydro-1H-Indene	164.1565006	0.7378	2.78	5.182	0	0	0	0	2	12	1
TCMC4967	C15H22O	2,3,3-Trimethyl-2-(3-Methylbuta-1,3-Dien-1-Yl)-6-Methylenecyclohexanone	218.1670653	3.181	3	4.548	1	0	17.07	2	1	16	0
TCMC4988	C15H24O	(3Z,7Z)-1,5,5,8-Tetramethyl-12-Oxa-Bicyclo[9.1.0]Dodeca-3,7-Diene	220.1827154	2.4043	3	4.314	1	0	12.53	0	2	16	0
TCMC5032	C10H18O	(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]Heptan-2-Ol,Isoborneol,L-Isoborneol	154.1357652	0.9432	2.45	2.734	1	1	20.23	0	2	11	0
TCMC5059	C15H22O	(3E,7Z)-3,7-Dimethyl-10-(Propan-2-Ylidene)Cyclodeca-3,7-Dienone,1-Trans,5-Trans Germacrone	218.1670653	3.5992	3	3.364	1	0	17.07	0	1	16	0
TCMC5116	C15H24O2	(3S,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione,Curdione	236.17763	1.6904	2.89	2.522	2	0	34.14	1	1	17	0
TCMC5117	C15H18O2	3,6,10-Trimethyl-7,8-Dihydrocyclodeca[B]Furan-4(11H)-One	230.1306798	2.585	2.89	2.601	1	0	30.21	0	2	17	0
TCMC5267	C11H18O2	4-Hydroxy-3,3,5-Trimethyl-4-Vinylcyclohexanone	182.1306798	0.8746	2.45	1.098	2	2	40.46	0	1	13	0
TCMC5279	C15H20O4	(4Ar,5R,5As,6Ar)-6A-Hydroxy-3,5A-Dimethyl-5-(3-Oxobutyl)-4,4A,5,5A,6,6A-Hexahydro-2H-Cyclopropa[F][1]Benzofuran-2-One	264.1361591	0.8109	2.67	1.213	4	1	63.6	3	3	19	0
TCMC5288	C15H22O2	(5R,6S,9S)-6-Methyl-3-(Propan-2-Ylidene)-9-(Prop-1-En-2-Yl)-1-Oxaspiro[4.4]Nonan-2-One	234.1619799	3.07	2.89	3.028	2	0	26.3	1	2	17	0
TCMC5304	C26H30O4	(2,4-Dihydroxy-6-Methoxyphenyl)(3-Methyl-2-(3-Methylbut-2-Enyl)-6-Phenylcyclohex-3-Enyl)Methanone	406.2144094	1.1457	3.88	7.093	1	2	66.76	6	3	30	1
TCMC5314	C15H20O3	(4Ar,5R,5As,6As)-3,5A-Dimethyl-5-(3-Oxobutyl)-4,4A,5,5A,6,6A-Hexahydro-2H-Cyclopropa[F][1]Benzofuran-2-One	248.1412445	1.2008	2.78	2.098	3	0	43.37	3	3	18	0
TCMC5325	C15H24	(S)-1-Methyl-4-(6-Methylhepta-1,5-Dien-2-Yl)Cyclohex-1-Ene,Β-Bisabolene	204.1878008	3.3746	3.11	5.551	0	0	0	4	1	15	1
TCMC5344	C15H22O2	(4As,5R,7As)-7A-Methyl-5-(Prop-1-En-2-Yl)-3-(Propan-2-Ylidene)-Hexahydrocyclopenta[B]Pyran-2(3H)-One	234.1619799	3.07	2.89	3.239	2	0	26.3	1	2	17	0
TCMC5345	C15H22O3	(3S,3As,5S,8As)-3A-Hydroxy-3,3',3',8-Tetramethyl-1,2,3,3A,4,8A-Hexahydro-6H-Spiro[Azulene-5,2'-Oxiran]-6-One	250.1568946	0.6263	2.78	1.119	3	1	49.83	0	3	18	0
TCMC5400	C15H22O2	(S)-6,10-Dimethyl-3-(Propan-2-Ylidene)Cyclodec-6-Ene-1,4-Dione,Dehydrocurdione	234.1619799	2.6228	2.89	2.039	2	0	34.14	0	1	17	0
TCMC5440	C15H24O2	4-((1S,6R,7R)-4-(2-Hydroxypropan-2-Yl)-1-Methylbicyclo[4.1.0]Hept-3-En-7-Yl)Butan-2-One	236.17763	1.2885	2.89	2.465	2	1	37.3	4	2	17	0
TCMC5487	C17H28O3	(1S,3R,6R,7R)-1-Methyl-7-(2-(2-Methyl-1,3-Dioxolan-2-Yl)Ethyl)-4-(Propan-2-Ylidene)Bicyclo[4.1.0]Heptan-3-Ol	280.2038448	1.191	3	2.865	3	1	38.69	3	3	20	0
TCMC5499	C15H24	(2R,4Ar,8Ar)-4A,8-Dimethyl-2-(Prop-1-En-2-Yl)-1,2,3,4,4A,5,6,8A-Octahydronaphthalene	204.1878008	2.6017	3.11	6.145	0	0	0	1	2	15	1
TCMC5543	C15H22O	(4S,5S)-5-Methyl-4-(Prop-1-En-2-Yl)-2-(Propan-2-Ylidene)-5-Vinylcyclohexanone	218.1670653	3.4555	3	3.506	1	0	17.07	2	1	16	0
TCMC5599	C15H24	(2S,4Ar)-1,1,5,5-Tetramethyl-1,3,4,5,6,7-Hexahydro-2H-2,4A-Methanonaphthalene,58924 Fluka,Isolongifolene	204.1878008	2.3819	3.11	6.198	0	0	0	0	3	15	1
TCMC5600	C15H24	(S)-2-Methyl-5-((R)-6-Methylhept-5-En-2-Yl)Cyclohexa-1,3-Diene	204.1878008	3.3391	3.11	6.354	0	0	0	4	1	15	1
TCMC5601	C15H22O2	(3R,3As,6R,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)-1,2,3,4,5,8A-Hexahydro-6H-3A,6-Epoxyazulen-6-Ol	234.1619799	2.327	2.89	1.748	2	1	29.46	0	3	17	0
TCMC5656	C15H16O	(3Az,6Z,8E)-3,8-Dimethyl-5-(Propan-2-Ylidene)Azulen-1(5H)-One	212.1201151	3.3629	3	3.314	1	0	17.07	0	2	16	0
TCMC5682	C10H16O	(1R)-1,4-Dimethyl-8-Methylene-2-Oxa-Bicyclo[3.2.1]Octane	152.1201151	1.1343	2.45	1.35	1	0	9.23	0	2	11	0
TCMC5742	C15H22O2	(1R,10R)-6,10-Dimethyl-3-(Propan-2-Ylidene)-11-Oxabicyclo[8.1.0]Undec-6-En-4-One	234.1619799	2.5695	2.89	2.16	2	0	29.6	0	2	17	0
TCMC5788	C15H26O	(1S,4R,4Ar,8Ar)-1-Isopropyl-4,7-Dimethyl-1,2,3,4,4A,5,6,8A-Octahydronaphthalen-4A-Ol	222.1983655	1.3641	3	4.054	1	1	20.23	1	2	16	0
TCMC5810	C15H24O2	(3S,3As,6R,8S,8As)-3,8-Dimethyl-5-(Propan-2-Ylidene)Octahydro-6H-3A,6-Epoxyazulen-6-Ol	236.17763	1.53	2.89	2.348	2	1	29.46	0	3	17	0
TCMC5878	C15H20	(S)-1-Isopropyl-4,7-Dimethyl-1,2-Dihydronaphthalene	200.1565006	2.1572	3.11	7.326	0	0	0	1	2	15	1
TCMC5899	C15H20O	(5R,6R)-3,6-Dimethyl-5-(Prop-1-En-2-Yl)-6-Vinyl-4,5,6,7-Tetrahydrobenzofuran	216.1514153	3.133	3	4.214	0	0	13.14	2	2	16	0
TCMC5903	C15H24	(1S,4As,8Ar)-1-Isopropyl-4,7-Dimethyl-1,2,4A,5,6,8A-Hexahydronaphthalene,Α-Muurolene	204.1878008	2.407	3.11	5.897	0	0	0	1	2	15	1
TCMC5915	C15H24	(3R,4R)-1-Isopropyl-4-Methyl-3-(Prop-1-En-2-Yl)-4-Vinylcyclohex-1-Ene	204.1878008	3.102	3.11	5.926	0	0	0	3	1	15	1
TCMC5992	C12H22O2	1-Heptylcyclobutanecarboxylic Acid	197.1541549	-2.7769	2.56	3.829	2	0	40.13	7	1	14	0
TCMC6083	C15H24O	(1Ar,7S,7As,7Br,Z)-1,1,4,7-Tetramethyl-1A,2,3,5,6,7,7A,7B-Octahydro-1H-Cyclopropa[E]Azulen-7-Ol	220.1827154	1.667	3	3.561	1	1	20.23	0	3	16	0
TCMC6115	C15H22O2	(5R,6S,9R)-6-Methyl-3-(Propan-2-Ylidene)-9-(Prop-1-En-2-Yl)-1-Oxaspiro[4.4]Nonan-2-One	234.1619799	3.07	2.89	3.028	2	0	26.3	1	2	17	0
TCMC6135	C15H24O3	(S)-6-((1R,4S,5S)-4,5-Dihydroxy-4-Methylcyclohex-2-Enyl)-2-Methylhept-2-En-4-One	252.1725446	0.9548	2.78	1.793	3	2	57.53	4	1	18	0
TCMC6171	C15H22O2	(3S,3As,8Ar)-3-Hydroxy-3-Methyl-8-Methylene-5-(Propan-2-Ylidene)-Hexahydroazulen-6(1H,2H,7H)-One	234.1619799	1.8298	2.89	1.54	2	1	37.3	0	2	17	0
TCMC6189	C15H24O3	(3S,3As,8R,8Ar)-3,8-Dihydroxy-3,8-Dimethyl-5-(Propan-2-Ylidene)-Hexahydroazulen-6(1H,2H,7H)-One	252.1725446	0.7404	2.78	1.151	3	2	57.53	0	2	18	0
TCMC6261	C15H24	(1Ar,7R,7Ar,7Bs)-1,1,7,7A-Tetramethyl-1A,2,3,5,6,7,7A,7B-Octahydro-1H-Cyclopropa[A]Naphthalene,Calarene	204.1878008	2.3854	3.11	6.298	0	0	0	0	3	15	1
TCMC6262	C15H24	(1R,3Ar,4R,7R,Z)-1,4-Dimethyl-7-(Prop-1-En-2-Yl)-1,2,3,3A,4,5,6,7-Octahydroazulene	204.1878008	2.6467	3.11	6.048	0	0	0	1	2	15	1
TCMC6344	C10H18O	(1R,2S,5S)-5-Isopropyl-2-Methylbicyclo[3.1.0]Hexan-2-Ol	154.1357652	0.5023	2.45	2.756	1	1	20.23	1	2	11	0
TCMC6556	C15H22O2	(S,Z)-6-Methyl-5-(3-Oxobutyl)-2-(Propan-2-Ylidene)Cyclohept-4-Enone	234.1619799	1.7017	2.89	1.85	2	0	34.14	3	1	17	0
TCMC6565	C15H24	(Z)-5-Isopropyl-3,8-Dimethyl-1,3A,4,5,6,8A-Hexahydroazulene	204.1878008	2.2138	3.11	5.897	0	0	0	1	2	15	1
TCMC6612	C15H22O2	(3E,7Z)-10-(1-Hydroxypropan-2-Ylidene)-3,7-Dimethylcyclodeca-3,7-Dienone	234.1619799	2.5085	2.89	1.905	2	1	37.3	1	1	17	0
TCMC6613	C15H24O2	(3R,10S)-3-Isopropyl-6,10-Dimethylcyclodec-6-Ene-1,4-Dione	236.17763	1.6904	2.89	2.522	2	0	34.14	1	1	17	0
TCMC6757	C15H18O3	(4As,5S,7As)-4A-Hydroxy-3,5-Dimethyl-8-Methylene-5,6,7,7A,8,9-Hexahydroazuleno[6,5-B]Furan-4(4Ah)-One	246.1255944	0.9223	2.78	1.374	2	1	50.44	0	3	18	0
TCMC6880	C15H24O	(S)-2-Methyl-6-(4-Methylcyclohex-3-En-1-Yl)Hepta-2,6-Dien-1-Ol	220.1827154	2.2839	3	3.67	1	1	20.23	5	1	16	0
TCMC6887	C15H24O	2-Methyl-6-(4-Methylcyclohexa-1,4-Dienyl)Heptan-4-One	220.1827154	2.3409	3	4.142	1	0	17.07	5	1	16	0
TCMC6955	C15H20O2	(5Z,9Z)-3,6,10-Trimethyl-7,8,11,11A-Tetrahydrocyclodeca[B]Furan-2(4H)-One	232.1463299	3.1071	2.89	2.905	2	0	26.3	0	2	17	0
TCMC7105	C15H18O3	(8S,8As)-8-Hydroxy-3,5,8A-Trimethyl-7,8,8A,9-Tetrahydronaphtho[2,3-B]Furan-4(6H)-One	246.1255944	0.7998	2.78	0.906	2	1	50.44	0	3	18	0
TCMC7316	C11H10O	Azulen-5-Ylmethanol	158.0731649	-0.4487	2.56	4.285	1	1	20.23	1	2	12	0
TCMC7368	C15H16O2	(S)-1,5,8-Trimethyl-7,8-Dihydronaphtho[2,1-B]Furan-9(6H)-One	228.1150298	1.4789	2.89	2.901	1	0	30.21	0	3	17	0
TCMC7369	C15H24O2	3-Hydroperoxy-2,6,6,9-Tetramethylcycloundeca-1,4,8-Triene	236.17763	3.7554	2.89	3.733	2	1	29.46	1	1	17	0

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Data Section	Select to Download
1. General Information of the Component
2. TCM Prescriptions with the Component
3. Putative Targets
4. Activity & References for Filtering Putative Targets
5. Ingredient Data & Chemical Structure Information (Properties, InChI, InChIkey, SMILES, etc.)

Component: Curcuma aeruginosa 莪术

Description of the Component

Component ID

Latin Name

English Name

Chinese Pinyin Name

中文名

TCM Properties

TCM Meridians

Therapeutic Class English

Therapeutic Class Chinese

Functions

Toxicity

Geo-authentic habitats (道地产区)

Reference

Barcode ID

Barcode Source

TCM Prescriptions with the Component

Targeted Human Proteins by the Ingredient of Component

Targeted Pathogenic Microbes by the Ingredient of Component

Ingredient Structrues

Ingredient ID: TCMC995

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC948

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7369

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7368

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7316

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7105

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6955

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6887

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6880

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6757

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6613

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6612

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6565

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6556

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6344

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6262

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6261

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6189

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6171

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6135

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6115

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6083

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5992

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5915

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5903

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5899

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5878

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5810

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5788

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5742