TCM-ID Component

Description of the Component

Component ID	TCMH623
Latin Name	Aconitum carmichaeli
English Name	Prepared common monkshood daughter root
Chinese Pinyin Name	Fu Zi
中文名	附子
TCM Properties	Extreme Hot,Pungent,Sweet
TCM Meridians	Spleen,Heart,Kidney
Therapeutic Class English	For warming interior
Therapeutic Class Chinese	温里
Functions	cause restoration from collapse, supplement body fire and reinforce yang, and dispel wind, cold and damp
Toxicity	Toxic
Geo-authentic habitats (道地产区)	NA
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAH2410-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMF2240	Mume Pills	乌梅丸
TCMFx2937	A Wei She Xiang Hua Ji Ointment	阿魏麝香化积膏
TCMFx2758	Aconite and Ginseng Decoction	附子人参汤
TCMF1652	Aconitum Heart Clearing Decoction	附子泻心汤
TCMFx2955	An Yang Gu Ben Ointment	安阳固本膏
TCMFx2976	Ba Wei Shen Qi Pills	八味肾气丸
TCMF3120	Bai Bu Zeng Li Pills	百补增力丸
TCMFx2990	Bai Hua She Ointment	白花蛇膏
TCMFx2415	Black Xi Pill	黑锡丹
TCMF2343	Bolus of Placenta Homimis	河车八味丸
TCMF3907	Bu Shen Ban Long Tablets	补肾斑龙片
TCMFx3915	Bu Shen Fang Chuan Tablets	补肾防喘片
TCMFx3554	Chun Xue An Capsules	春血安胶囊
TCMFx726	Chun Xue An Capsule	春血安胶囊
TCMF2691	Cinnamon Twig, Peony, and Anemarrhena Decoction	桂枝芍药知母汤
TCMFx2524	Cold Wheeze Pills	冷哮丸
TCMF2571	Combined Recipe WCXH Decoction
TCMFx2338	Cuscutae Pills	菟丝子丸
TCMF3700	Da Hu Zhuang Yuan Pills	打虎壮元丸
TCMF2248	Decoction for Lengthening Age and Relieving Aphasia
TCMF1734	Decoction for Warming Spleen; Spleen Warming Decoction	温脾汤
TCMF1820	Decoction of Aconiti and Cinnamomi	乌头桂枝汤
TCMF1718	Decoction of Cinnamomi and Aconiti	桂枝附子汤
TCMF2132	Decoction of Cinnamomi, Paeoniae and Anemarrhenae	桂枝芍药知母汤
TCMFx1565	Decoction of Ephedrae, Asari and Aconiti	麻黄细辛附子汤
TCMF2560	Decoction of Rehmanniae	地黄引子
TCMFx1537	Decoction of Rhei and Aconiti Praeparata	大黄附子汤
TCMFx1222	Decoction of Rhei and Aconiti Praeparata	大黄附子汤
TCMF2842	Di Huang Decoction	地黄饮子
TCMFx686	Ding Chuan Ointment	定喘膏
TCMFx3528	Ding Chuan Ointment	定喘膏
TCMFx3719	Du Jiao Ointment	独角膏
TCMF3807	Du Zhong Zhuang Gu Capsules	杜仲壮骨胶囊
TCMF3815	Du Zhong Zhuang Gu Pills	杜仲壮骨丸
TCMFx2709	Eight-Ingredient Pill with Rehmannia	八味地黄丸
TCMFx2676	Ephedra, Asarum, and Prepared Aconite Decoction	麻黄附子细辛汤
TCMF3087	Er Yi Pills	二益丸
TCMF3375	Feng Shi Gao Yao	风湿膏药
TCMF3424	Feng Shi Han Tong Tablets	风湿寒痛片
TCMF3432	Feng Shi Wine	风湿酒
TCMFx3556	Feng Shi Zhi Tong Yao Wine	风湿止痛药酒
TCMF3582	Feng Tong Ning Tablets	风痛宁片
TCMF3598	Feng Tong Pills	风痛丸
TCMF1673	Four Contrary plus Ginseng Decoction	四逆加人参汤
TCMF2703	Frigid Extremities Decoction	四逆汤
TCMF3540	Fu Fang Ge Qing Tablets	复方蛤青片
TCMF3547	Fu Fang Ge Qing Zhu She Oral Liquid	复方蛤青注射液
TCMF788	Fu Fang Ge Qing Tablet	复方蛤青片
TCMF3117	Fu Gui Feng Shi Ointment	附桂风湿膏
TCMFx627	Fu Gui Gu Tong Capsule	附桂骨痛胶囊
TCMFx628	Fu Gui Gu Tong Granules	附桂骨痛颗粒
TCMFx626	Fu Gui Gu Tong Tablet	附桂骨痛片
TCMF3124	Fu Gui Zi Jin Ointment	附桂紫金膏
TCMFx3133	Fu Pian Oral Liquid	附片液
TCMF2803	Fu Zi Decoction	附子汤
TCMF7304	Fu Zi Li Zhong Decoction	附子理中汤
TCMF3157	Fu Zi Li Zhong Oral Liquid	附子理中液
TCMF3149	Fu Zi Li Zhong Pills	附子理中丸
TCMF625	Fu Zi Li Zhong Tablet	附子理中片
TCMF3141	Fu Zi Li Zhong Tablets	附子理中片
TCMF1254	Fuzi Lizhong Pills, Aconite Bolus for Regulating the Function of Middle-jiao	附子理中丸
TCMF1715	Fuzi Lizhong Pills, Aconite Bolus for Regulating the Function of Middle-jiao	附子理中丸
TCMFx1776	FZDH Uramia Decoction	附子大黄汤
TCMF3502	Gan Lu Ointment	甘露膏
TCMF2316	Gastrodia Capsule	天麻胶囊
TCMFx1862	GFYL Decoction	桂附益苓汤
TCMF1645	Ginseng Aconitum Decoction	参附汤
TCMF638	Gu Ben Tong Xue Granules	固本统血颗粒
TCMF3401	Gu Ci Tablets	骨刺片
TCMF640	Gu Shen Ding Chuan Pills	固肾定喘丸
TCMF3630	Gu Shen Ding Chuan Pills	固肾定喘丸
TCMF3703	Guan Jie Zhen Tong Ointment	关节镇痛膏
TCMFx4102	Gui Fu Di Huang Pills	桂附地黄丸
TCMFx4096	Gui Fu Di Huang Tablets	桂附地黄片
TCMFx900	Gui Fu Di Huang Capsule	桂附地黄胶囊
TCMFx899	Gui Fu Di Huang Pills	桂附地黄丸
TCMFx4054	Gui Lu Er Jiao Pills	龟鹿二胶丸
TCMFx4075	Gui Lu Zi Shen Pills	龟鹿滋肾丸
TCMF2804	Gui Zhi Shao Yao Zhi Mu Decoction	桂枝芍药知母汤
TCMF7431	Gui Zhi Shao Yao Zhi Mu Decoction	桂枝芍药知母汤
TCMF1275	Guifu Lizhong Pills	桂附理中丸
TCMF1846	Guifu Lizhong Pills	桂附理中丸
TCMFx4114	Hai Ma Bu Shen Pills	海马补肾丸
TCMFx4121	Hai Ma Duo Bian Pills	海马多鞭丸
TCMFx4129	Hai Ma San Shen Pills	海马三肾丸
TCMFx4144	Hai Ma Wan Ying Ointment	海马万应膏
TCMF4234	Han Re Bi Capsules	寒热痹胶囊
TCMF4241	Han Re Bi Granules	寒热痹颗粒
TCMF4249	Han Shi Bi Granules	寒湿痹颗粒
TCMF4257	Han Shi Bi Tablets	寒湿痹片
TCMF2091	Heart Boosting Decoction	强心饮
TCMFx4420	Hei Xi Dan	黑锡丹
TCMF4497	Hong Mao Yao Wine	鸿茅药酒
TCMF2102	HQZF Decoction
TCMF4232	Hui Chun Wine	回春酒
TCMFx4274	Hui Tian Zai Zao Pills	回天再造丸
TCMFx4297	Huo Li Yuan Oral Liquid	活力源口服液
TCMFx4305	Huo Li Yuan Tablets	活力源片
TCMFx4325	Huo Luo Pills	活络丸
TCMF4366	Huo Xin Pills	活心丸
TCMF4818	Jia Wei Tian Me Capsules	加味天麻胶囊
TCMF4920	Jian Bu Qiang Shen Pills	健步强身丸
TCMF4929	Jian Bu Zhuang Gu Pills	健步壮骨丸
TCMF4897	Jian Shen Tablets	建参片
TCMF4309	Jian Shen Yao Wine	健身药酒
TCMFx3992	Jin Kui Shen Qi Pills	金匮肾气丸
TCMF2255	Jin Warming Decoction	温经活血汤
TCMFx2213	Jisheng Shenqi Pills	济生肾气丸
TCMFx1348	Jisheng Shenqi Pills; Kidney Yang Restoring Edema Reducing Pill	济生肾气丸
TCMFx7262	Jisheng Shenqi Pills; Kidney Yang Restoring Edema Reducing Pill	济生肾气丸
TCMFx4716	Ju He Shan Qi Pills	橘核疝气丸
TCMF2822	Kai Xin Powder	开心散
TCMFx2069	Kidney Qi Pill	肾气丸
TCMFx2022	Kidney Qi Pills from the Golden Cabinet	金匮肾气丸
TCMFx2771	Life Preserving Kidney Qi Pill	牛车肾气丸
TCMF2457	Life Support and Soil Care Decoction
TCMFx4636	Long Feng Bao Capsules	龙凤宝胶囊
TCMF4651	Long Ling Chun Yao Wine	龙苓春药酒
TCMF2115	Longevity Powder	龟龄集
TCMF1335	Longevity Powder	龟龄集
TCMFx4978	Lv Ying Ointment	绿樱膏
TCMFx7277	Ma Huang Fu Zi Xi Xin Decoction	麻黄附子细辛汤
TCMF2558	Major Decoction of Ledebouriellae	大防风汤
TCMF2710	Major Ledebouriella Decoction	大防风汤
TCMF4254	Man Jing Pills	慢惊丸
TCMF2317	Medicated Wine of Ginseng and Pilose Antler	参茸酒
TCMF2424	Minor Life Extending Decoction	小续命汤
TCMF2680	Minor Prolong Life Decoction	小续命汤
TCMF1387	Mugua Pills	木瓜丸
TCMF2419	Mugua Pills; Chaenomeles Fruit Pill	木瓜丸
TCMF4639	Nan Bao Capsules	男宝胶囊
TCMFx4378	Nv Bao Capsules	女宝胶囊
TCMF2199	Pain Releasing Decoction	定痛汤
TCMFx4470	Pao Tian Hong Wine	炮天红酒
TCMF2529	Pellet for Impotence	赞育丹
TCMF2778	Peony, Licorice, and Prepared Aconite Decoction	芍药甘草附子汤
TCMF2207	Pill for Controlling Fluid	巩堤丸
TCMFx7246	Pill of Eight Ingredients with Rehmannia	八味地黄丸
TCMF1358	Pill of Mume; Mume Pill	乌梅丸
TCMFx2331	Pills for Leucorrhagia	内补丸
TCMF4666	Ping Feng Sheng Mai Capsules	屏风生脉胶囊
TCMF2421	Powder for Invigorating Spleen	十脾散
TCMFx1560	Powder of Coix Seed, Aconite Root and Patrinia	薏苡附子败酱散
TCMF593	Qi Li Qiang Xin Capsule	芪苈强心胶囊
TCMFx4874	Qi She Zhui Feng Wine	蕲蛇追风酒
TCMF5177	Qiang Li Tian Ma Du Zhong Capsules	强力天麻杜仲胶囊
TCMFx4991	Qiang Shen Zhen Tong Pills	强肾镇痛丸
TCMF4999	Qiang Xin Pills	强心丸
TCMFx5139	Qu Feng Shi Ointment	祛风湿膏
TCMF1431	Qufeng Shujin Pills	祛风舒筋丸
TCMF2606	Qufeng Shujin Pills	祛风舒筋丸
TCMF2532	Red Jujube and Black Bean Decoction
TCMFx5537	Ren Shen Zai Zao Pills	人参再造丸
TCMFx2719	Rhubarb and Prepared Aconite Decoction	大黄附子汤
TCMF2291	Roundworm Stablizing Decoction of Fructus Mume	乌梅汤
TCMFx5920	San Ceng Hui Xiang Pills	三层茴香丸
TCMF5201	San Feng Huo Luo Pills	散风活络丸
TCMFx5170	San Shen Pills	三肾丸
TCMFx5178	San Wu Jiao	三乌胶
TCMFx5185	San Wu Jiao Pills	三乌胶丸
TCMFx5162	She Xiang Jie Tong Ointment	麝香解痛膏
TCMFx3188	Shen Fu Zhu She Oral Liquid	参附注射液
TCMF3196	Shen Gui Li Zhong Pills	参桂理中丸
TCMFx5328	Shen Hai Long Capsules	深海龙胶囊
TCMFx5336	Shen Hai Long Pills	深海龙丸
TCMFx5487	Shen Kang Ning Tablets	肾康宁片
TCMFx3517	Shen Rong Bian Pills	参茸鞭丸
TCMFx3541	Shen Rong Duo Bian Wine	参茸多鞭酒
TCMFx3551	Shen Rong Gu Ben Huan Shao Pills	参茸固本还少丸
TCMFx3574	Shen Rong Hei Xi Pills	参茸黑锡丸
TCMFx3597	Shen Rong Lu Tai Ointment	参茸鹿胎膏
TCMFx3617	Shen Rong Qiang Shen Oral Liquid	参茸强肾口服液
TCMFx3622	Shen Rong San Bian Pills	参茸三鞭丸
TCMF3589	Shen Rong Wine	参茸酒
TCMF724	Shen Fu Qiang Xin Pills	参附强心丸
TCMF2827	Shi Pi Powder	实脾散
TCMFx5605	Shu Feng Zai Zao Pills	疏风再造丸
TCMF7372	Si Ni Decoction	四逆汤
TCMFx1823	Small Bolus for Activating Channels and Collaterals	小活络丹
TCMF2470	Spleen Strengthening Decoction	实脾饮
TCMFx5181	Suo Yang Bu Shen Capsules	锁阳补肾胶囊
TCMF2093	Tablet for Chronic Nephritis	肾康宁片
TCMF1328	Tablet for Chronic Nephritis	肾康宁片
TCMF5291	Tan Yin Pills	痰饮丸
TCMFx5342	Te Zhi Gou Pi Ointment	特制狗皮膏
TCMF261	Tian Ma Qu Feng Bu Tablet	天麻祛风补片
TCMF5434	Tian Ma Qu Feng Bu Tablets	天麻祛风补片
TCMF5426	Tian Ma Tablets	天麻片
TCMF5411	Tian Me Capsules	天麻胶囊
TCMF1357	Tianma Pills; Gastrodia Tuber Bolus	天麻丸
TCMF2238	Tianma Pills; Gastrodia Tuber Bolus	天麻丸
TCMFx982	Tong Bi Capsule	通痹胶囊
TCMFx5051	Tong Ren Da Huo Luo Pills	同仁大活络丸
TCMFx1752	Trichosanthis and Dianthi Pills	瓜蒌瞿麦丸
TCMFx2706	True Warrrior Decoction	真武汤
TCMF5385	Wan Ying Bao Zhen Ointment	万应宝珍膏
TCMF554	Wang Bi Granules	尪痹颗粒
TCMF5409	Wang Bi Granules	尪痹颗粒
TCMF553	Wang Bi Tablet	尪痹片
TCMF5417	Wang Bi Tablets	尪痹片
TCMFx5462	Wei Da Kang Granules	微达康颗粒
TCMFx5449	Wei Da Kang Ointment	微达康膏
TCMFx5468	Wei Da Kang Oral Liquid	微达康口服液
TCMFx1154	Wei Da Kang Oral Liquid	微达康口服液
TCMF5924	Wen Jing Pills	温经丸
TCMF2819	Wen Pi Decoction	温脾汤
TCMF5951	Wen Pi Zhi Xie Pills	温脾止泻丸
TCMF5969	Wen Wei Shu Capsules	温胃舒胶囊
TCMF5977	Wen Wei Shu Granules	温胃舒颗粒
TCMF5269	Wu Mei Pills	乌梅丸
TCMF2821	Xiao Xu Ming Decoction	小续命汤
TCMF7302	Xiao Xu Ming Decoction	小续命汤
TCMFx6757	Xin Bao Pills	心宝丸
TCMFx6806	Xin Li Pills	心力丸
TCMF6458	Xue Bao Capsules	血宝胶囊
TCMFx6436	Xue Shang Yi Zhi Hao Su Xiao Zhi Tong Cha Ji	雪上一枝蒿速效止痛搽剂
TCMF6133	Yao Shen Ointment	腰肾膏
TCMF1915	Yellow Earth Decoction	黄土汤
TCMFx6374	Yi He Chun Capsules	颐和春胶囊
TCMF1016	Yi Shen Ling Granules	益肾灵颗粒
TCMF6630	Yi Shen Ling Infusion	益肾灵冲剂
TCMFx552	Yi Xian Pills	医痫丸
TCMFx6747	Yi Xin Pills	益心丸
TCMFx934	Yi Xin Pills	益心丸
TCMF6348	Yi Zhu Tian Wine	一柱天酒
TCMF6266	You Gui Pills	右归丸
TCMF2059	Yougui Decoction	右归饮
TCMF6299	Yu Biao Bu Shen Pills	鱼鳔补肾丸
TCMFx6352	Yu Long You	玉龙油
TCMFx470	Zai Zao Pills	再造丸
TCMF7422	Zai Zao Powder	再造散
TCMF2341	Zaizao Powder	再造散
TCMFx6754	Zan Hua Lu Rong Pills	赞化鹿茸丸
TCMFx2000	ZD Ginger Decoction
TCMF6785	Zeng Li Zai Sheng Pills	增力再生丸
TCMFx7374	Zhen Wu Decoction	真武汤
TCMFx2797	Zhen Wu Decoction	真武汤
TCMFx6310	Zheng Gu Ointment	正骨膏
TCMF393	Zheng Tian Capsule	正天胶囊
TCMF392	Zheng Tian Pills	正天丸
TCMF6360	Zheng Tian Pills	正天丸
TCMFx1745	Zhenwu Decoction	真武汤
TCMFx6084	Zhi Shan Hui Xiang Pills	治疝茴香丸
TCMFx314	Zhi Xue Fu Mai Recipe	止血复脉合剂
TCMFx6224	Zhong Feng Zai Zao Pills	中风再造丸
TCMF6491	Zhuang Gu Pills	壮骨丸
TCMF6530	Zhuang Yang Jian Wei Pills	壮阳健威丸

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT1	EHMT2	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Transferase	Q96KQ7
TCMT11	HIF1A	Hypoxia-inducible factor 1 alpha	Transcription factor	Q16665
TCMT125	GBA	Beta-glucocerebrosidase	Hydrolase	P04062
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
TCMT248	CXCL8	Interleukin-8	Unclassified	P10145
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT33	CYP3A4	Cytochrome P450 3A4	Oxidoreductase	P08684
TCMT38	DRD2	Dopamine D2 receptor	GPCR	P14416
TCMT6	NFKB1	Nuclear factor NF-kappa-B p105 subunit	Transcription factor	P19838
TCMT651	DRD3	Dopamine D3 receptor	GPCR	P35462
TCMT69	THRB	Thyroid hormone receptor beta-1	Nuclear receptor	P10828
TCMT8	KDM4E	Lysine-specific demethylase 4D-like	Oxidoreductase	B2RXH2
TCMT87	CYP2C9	Cytochrome P450 2C9	Oxidoreductase	P11712

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1438	Plasmodium falciparum

Ingredient Structrues

Ingredient ID: TCMC7276
Formula: C33H45NO9

Common Name	Isodelphinine
IUPAC Name	[(1S,2R,3R,4S,5S,6R,7S,8R,9R,10R,13S,16S,17R,18R)-8-acetyloxy-7-hydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)C)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)c2ccccc2)[C@H]([C@@H]1O)OC)OC(=O)C)OC
Standard InCHI	InChI=1S/C33H45NO9/c1-17(35)43-33-22-20(14-19(25(40-5)29(33)36)24(22)42-30(37)18-10-8-7-9-11-18)32-21(39-4)12-13-31(16-38-3)15-34(2)28(32)23(33)26(41-6)27(31)32/h7-11,19-29,36H,12-16H2,1-6H3/p+1/t19-,20+,21-,22+,23-,24-,25+,26-,27+,28+,29-,31-,32-,33+/m0/s1
Standard InCHIKey	MYVIYJCHYUIXLX-NNASVCRSSA-O
External Identifiers	ChEMBL [N/A]; PubChem [102146471];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7248
Formula: C25H39NO7

Common Name	Delbrunine
IUPAC Name	(1S,2R,3R,4S,5S,6S,8R,12S,13S,16S,19S,20R,21S)-14-ethyl-6,21-dimethoxy-16-(methoxymethyl)-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosane-4,19-diol
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@H](OC)[C@]2([C@H]3[NH+](C1)CC)OCO[C@@]12[C@@H]2[C@H]4C[C@@H]([C@@H]2O)[C@H](C1)OC)O
Standard InCHI	InChI=1S/C25H39NO7/c1-5-26-10-22(11-29-2)7-6-16(27)24-14-8-13-15(30-3)9-23(17(14)18(13)28)25(21(24)26,33-12-32-23)20(31-4)19(22)24/h13-21,27-28H,5-12H2,1-4H3/p+1/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25-/m1/s1
Standard InCHIKey	MSIFWQXGXCPJTR-DIZROUMASA-O
External Identifiers	ChEMBL [N/A]; PubChem [101986490];
Reference of Component-Ingredient Pair	20550959

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7243
Formula: C35H49NO9

Common Name	Vilmorrianine C
IUPAC Name	[(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18R)-8-acetyloxy-11-ethyl-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)c2ccc(cc2)OC)[C@H](C1)OC)OC(=O)C)OC
Standard InCHI	InChI=1S/C35H49NO9/c1-8-36-17-33(18-39-3)14-13-25(42-6)35-23-15-22-24(41-5)16-34(45-19(2)37,27(31(35)36)29(43-7)30(33)35)26(23)28(22)44-32(38)20-9-11-21(40-4)12-10-20/h9-12,22-31H,8,13-18H2,1-7H3/p+1/t22-,23-,24+,25+,26-,27+,28+,29+,30-,31-,33+,34-,35+/m1/s1
Standard InCHIKey	LYUPEIXJYAJCHL-YKLHRILBSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101939158];
Reference of Component-Ingredient Pair	24380280

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7242
Formula: C35H49NO10

Common Name	Crassicauline A
IUPAC Name	[(1S,2R,3R,4R,5S,6S,8R,9R,10R,13S,16S,17R,18R)-8-acetyloxy-11-ethyl-5-hydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@]([C@@H]2OC(=O)c2ccc(cc2)OC)([C@H](C1)OC)O)OC(=O)C)OC
Standard InCHI	InChI=1S/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21(41-4)12-10-20/h9-12,22-30,39H,8,13-18H2,1-7H3/p+1/t22-,23+,24+,25-,26+,27+,28-,29-,30-,32+,33+,34-,35+/m1/s1
Standard InCHIKey	GAZDXIGXYWVWQX-IBOHHWAHSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101939157];
Reference of Component-Ingredient Pair	19652403

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7102
Formula: C25H39NO7

Common Name	Deltamine
IUPAC Name	(1R,2S,3S,4S,5R,6S,8R,12S,13S,16R,19S,20R,21S)-14-ethyl-4,6,19-trimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosane-2,21-diol
Canonical SMILES	CO[C@H]1C[C@@]23OCO[C@]43[C@@H](O)[C@H]3[C@@]5([C@@]6(C[C@H]1[C@@H]([C@H]26)OC)O)[C@@H]4[NH+](CC)C[C@]3(C)CC[C@@H]5OC
Standard InCHI	InChI=1S/C25H39NO7/c1-6-26-11-21(2)8-7-15(30-4)24-18(21)19(27)25(20(24)26)23(32-12-33-25)10-14(29-3)13-9-22(24,28)17(23)16(13)31-5/h13-20,27-28H,6-12H2,1-5H3/p+1/t13-,14+,15+,16+,17+,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1
Standard InCHIKey	GLMFFCVWRKKBJB-ZVAWHEGMSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101289626];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7093
Formula: C49H77NO10

Common Name	Lipo-14-O-Anisoylbikhaconine
IUPAC Name	[(1S,2R,3R,4R,5S,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-8-hexadecanoyloxy-5-hydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)O[C@]12C[C@H](OC)[C@@]3([C@@H]([C@H]1[C@@H](C3)[C@@]13[C@H]4[C@@H]2[C@H](OC)[C@@H]1[C@@](C[NH+]4CC)(COC)CC[C@@H]3OC)OC(=O)c1ccc(cc1)OC)O
Standard InCHI	InChI=1S/C49H77NO10/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-38(51)60-48-30-37(57-6)47(53)29-35(39(48)44(47)59-45(52)33-23-25-34(55-4)26-24-33)49-36(56-5)27-28-46(32-54-3)31-50(9-2)43(49)40(48)41(58-7)42(46)49/h23-26,35-37,39-44,53H,8-22,27-32H2,1-7H3/p+1/t35-,36+,37+,39-,40+,41+,42-,43-,44-,46+,47+,48-,49+/m1/s1
Standard InCHIKey	WEMXLICPIWQSDO-VNBOLVCZSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101253596];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7092
Formula: C33H47NO9

Common Name	14-O-Veratroylneoline
IUPAC Name	[(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 3,4-dimethoxybenzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)c2ccc(c(c2)OC)OC)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C33H47NO9/c1-7-34-15-31(16-38-2)11-10-23(35)33-19-13-18-22(41-5)14-32(37,25(29(33)34)27(42-6)28(31)33)24(19)26(18)43-30(36)17-8-9-20(39-3)21(12-17)40-4/h8-9,12,18-19,22-29,35,37H,7,10-11,13-16H2,1-6H3/p+1/t18-,19-,22+,23+,24-,25+,26+,27+,28-,29-,31+,32-,33+/m1/s1
Standard InCHIKey	LZXVEXAXOOENIF-JHHKJKCRSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101253594];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7091
Formula: C32H45NO8

Common Name	14-O-Anisoylneoline
IUPAC Name	[(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)c2ccc(cc2)OC)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C32H45NO8/c1-6-33-15-30(16-37-2)12-11-22(34)32-20-13-19-21(39-4)14-31(36,24(28(32)33)26(40-5)27(30)32)23(20)25(19)41-29(35)17-7-9-18(38-3)10-8-17/h7-10,19-28,34,36H,6,11-16H2,1-5H3/p+1/t19-,20-,21+,22+,23-,24+,25+,26+,27-,28-,30+,31-,32+/m1/s1
Standard InCHIKey	PMCAUYATZKXGHU-QXBSOJDVSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101253593];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7090
Formula: C33H45NO7

Common Name	14-O-Cinnamoylneoline
IUPAC Name	[(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] (E)-3-phenylprop-2-enoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)/C=C/c2ccccc2)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C33H45NO7/c1-5-34-17-31(18-38-2)14-13-23(35)33-21-15-20-22(39-3)16-32(37,26(30(33)34)28(40-4)29(31)33)25(21)27(20)41-24(36)12-11-19-9-7-6-8-10-19/h6-12,20-23,25-30,35,37H,5,13-18H2,1-4H3/p+1/b12-11+/t20-,21-,22+,23+,25-,26+,27+,28+,29-,30-,31+,32-,33+/m1/s1
Standard InCHIKey	QNCJLCAJHJQEGR-ALVJYROXSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101253592];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7049
Formula: C26H41NO7

Common Name	Bullatine C
IUPAC Name	[(1S,2R,3R,4S,5R,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] acetate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC(=O)C)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C26H41NO7/c1-6-27-11-24(12-31-3)8-7-17(29)26-15-9-14-16(32-4)10-25(30,18(15)20(14)34-13(2)28)19(23(26)27)21(33-5)22(24)26/h14-23,29-30H,6-12H2,1-5H3/p+1/t14-,15-,16+,17+,18-,19+,20+,21+,22-,23-,24+,25-,26+/m1/s1
Standard InCHIKey	RVSYWRBZSPBTQV-DKHSYLGWSA-O
External Identifiers	ChEMBL [N/A]; PubChem [101021575];
Reference of Component-Ingredient Pair	10978212

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7041
Formula: C47H73NO10

Common Name	Lipohypaconitine
IUPAC Name	[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13S,16S,17R,18R)-8-hexadecanoyloxy-5,7-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)O[C@]12[C@@H](O)[C@H](OC)[C@@]3([C@@H]([C@H]1[C@@H](C3)[C@@]13[C@H]4[C@@H]2[C@H](OC)[C@@H]1[C@@](C[NH+]4C)(COC)CC[C@@H]3OC)OC(=O)c1ccccc1)O
Standard InCHI	InChI=1S/C47H73NO10/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-25-34(49)58-47-35-32(28-45(52,42(56-6)40(47)50)41(35)57-43(51)31-23-20-19-21-24-31)46-33(54-4)26-27-44(30-53-3)29-48(2)39(46)36(47)37(55-5)38(44)46/h19-21,23-24,32-33,35-42,50,52H,7-18,22,25-30H2,1-6H3/p+1/t32-,33+,35-,36+,37+,38-,39-,40+,41-,42+,44+,45-,46+,47-/m1/s1
Standard InCHIKey	CNWTUSBZAWJZAB-ZSMAVKMRSA-O
External Identifiers	ChEMBL [N/A]; PubChem [100986276];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7015
Formula: C26H43NO7

Common Name	Delphatine
IUPAC Name	(1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-4,6,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@H](OC)[C@]([C@H]3[NH+](C1)CC)(O)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC)[C@H](C1)OC)O)OC
Standard InCHI	InChI=1S/C26H43NO7/c1-7-27-12-23(13-30-2)9-8-17(32-4)25-15-10-14-16(31-3)11-24(28,18(15)19(14)33-5)26(29,22(25)27)21(34-6)20(23)25/h14-22,28-29H,7-13H2,1-6H3/p+1/t14-,15-,16+,17+,18-,19+,20-,21+,22+,23+,24-,25+,26-/m1/s1
Standard InCHIKey	FYNCELMSVIDJLX-FQCWPTJPSA-O
External Identifiers	ChEMBL [N/A]; PubChem [97960151];
Reference of Component-Ingredient Pair	18608773

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7011
Formula: C24H39NO6

Common Name	Bullatine B
IUPAC Name	(1S,2R,3R,4S,5S,6S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2O)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C24H39NO6/c1-5-25-10-22(11-29-2)7-6-15(26)24-13-8-12-14(30-3)9-23(28,16(13)18(12)27)17(21(24)25)19(31-4)20(22)24/h12-21,26-28H,5-11H2,1-4H3/p+1/t12-,13-,14+,15+,16-,17+,18+,19+,20-,21-,22+,23-,24+/m1/s1
Standard InCHIKey	XRARAKHBJHWUHW-SMCICNQZSA-O
External Identifiers	ChEMBL [N/A]; PubChem [95371629];
Reference of Component-Ingredient Pair	29076119

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7003
Formula: C22H33NO2

Common Name	Denudatine
IUPAC Name	(1S,5R,8R,9R,10S,11R,13R,14S,15S,16R)-7-ethyl-5-methyl-12-methylidene-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecane-11,14-diol
Canonical SMILES	CC[NH+]1C[C@]2(C)CCC[C@]34[C@H]1[C@H](C[C@H]23)[C@]12[C@H]4[C@@H](O)[C@H](CC1)C(=C)[C@H]2O
Standard InCHI	InChI=1S/C22H33NO2/c1-4-23-11-20(3)7-5-8-22-15(20)10-14(18(22)23)21-9-6-13(12(2)19(21)25)16(24)17(21)22/h13-19,24-25H,2,4-11H2,1,3H3/p+1/t13-,14+,15-,16+,17-,18-,19-,20+,21+,22+/m1/s1
Standard InCHIKey	OVXLNQAYPUEDSI-ZAWREGRRSA-O
External Identifiers	ChEMBL [N/A]; PubChem [92854548];
Reference of Component-Ingredient Pair	3776545

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC7002
Formula: C27H41NO8

Common Name	Deltaline
IUPAC Name	[(1R,2S,3S,4S,5R,6S,8R,12S,13S,16R,19S,20R,21S)-14-ethyl-2-hydroxy-4,6,19-trimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-21-yl] acetate
Canonical SMILES	CO[C@H]1C[C@@]23OCO[C@]43[C@@H](OC(=O)C)[C@H]3[C@@]5([C@@]6(C[C@H]1[C@@H]([C@H]26)OC)O)[C@@H]4[NH+](CC)C[C@]3(C)CC[C@@H]5OC
Standard InCHI	InChI=1S/C27H41NO8/c1-7-28-12-23(3)9-8-17(32-5)26-20(23)21(36-14(2)29)27(22(26)28)25(34-13-35-27)11-16(31-4)15-10-24(26,30)19(25)18(15)33-6/h15-22,30H,7-13H2,1-6H3/p+1/t15-,16+,17+,18+,19+,20-,21+,22+,23+,24+,25-,26-,27-/m1/s1
Standard InCHIKey	DTTPWCNKTMQMTE-TYNNPWLESA-O
External Identifiers	ChEMBL [N/A]; PubChem [92854547];
Reference of Component-Ingredient Pair	22816291

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6856
Formula: C33H47NO9

Common Name	Neojiangyouaconitine
IUPAC Name	[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13S,16S,17R,18R)-11-ethyl-5,7-dihydroxy-6,8,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@]([C@@H]2OC(=O)c2ccccc2)([C@H]([C@@H]1O)OC)O)OC)OC
Standard InCHI	InChI=1S/C33H47NO9/c1-7-34-16-30(17-38-2)14-13-20(39-3)32-19-15-31(37)27(43-29(36)18-11-9-8-10-12-18)21(19)33(42-6,26(35)28(31)41-5)22(25(32)34)23(40-4)24(30)32/h8-12,19-28,35,37H,7,13-17H2,1-6H3/p+1/t19-,20+,21-,22+,23+,24-,25-,26+,27-,28+,30+,31-,32+,33-/m1/s1
Standard InCHIKey	WXQMJWAPTHUPHW-FBYRGYIKSA-O
External Identifiers	ChEMBL [N/A]; PubChem [60155505];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6855
Formula: C34H47NO10

Common Name	Deoxyaconitine
IUPAC Name	[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13S,16S,17R,18R)-8-acetyloxy-11-ethyl-5,7-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2[C@@H](OC)[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@]([C@@H]2OC(=O)c2ccccc2)([C@H]([C@@H]1O)OC)O)OC(=O)C)OC
Standard InCHI	InChI=1S/C34H47NO10/c1-7-35-16-31(17-40-3)14-13-21(41-4)33-20-15-32(39)28(44-30(38)19-11-9-8-10-12-19)22(20)34(45-18(2)36,27(37)29(32)43-6)23(26(33)35)24(42-5)25(31)33/h8-12,20-29,37,39H,7,13-17H2,1-6H3/p+1/t20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1
Standard InCHIKey	PHASMOUKYDUAOZ-YNOWHOKFSA-O
External Identifiers	ChEMBL [N/A]; PubChem [60155415];
Reference of Component-Ingredient Pair	20506817

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6844
Formula: C24H39NO5

Common Name	Talatisamine
IUPAC Name	(1S,2R,3R,4S,5S,6S,8S,9S,10R,13S,16S,17R)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2C[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2O)[C@H](C1)OC)O)OC
Standard InCHI	InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/p+1/t13-,14-,15+,16+,17-,18+,19-,20+,21-,22+,23+,24-/m1/s1
Standard InCHIKey	BDCURAWBZJMFIK-OGVVJMRYSA-O
External Identifiers	ChEMBL [N/A]; PubChem [57506227];
Reference of Component-Ingredient Pair	26767293

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6618
Formula: C22H35NO4

Common Name	Carmichaeline
IUPAC Name	(1S,2R,3R,4S,5S,6S,8S,9S,10R,13R,16S,17R)-11-ethyl-6-methoxy-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
Canonical SMILES	CC[NH+]1C[C@]2(C)CC[C@@H]([C@]34[C@H]1[C@H](C[C@H]23)[C@@]1(O)C[C@@H]([C@H]2C[C@@H]4[C@@H]1[C@H]2O)OC)O
Standard InCHI	InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/p+1/t11-,12-,13+,14+,15-,16+,17-,18+,19-,20+,21+,22-/m1/s1
Standard InCHIKey	HKQZUYOVMYOFIT-JEJCSOMWSA-O
External Identifiers	ChEMBL [N/A]; PubChem [25083395];
Reference of Component-Ingredient Pair	21417277

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6611
Formula: C34H47NO11

Common Name	Aconitine
IUPAC Name	[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	COC[C@@]12C[NH+](CC)[C@H]3[C@]4([C@@H]2[C@@H](OC)[C@@H]3[C@@]2([C@@H]3[C@H]4C[C@@]([C@@H]3OC(=O)c3ccccc3)([C@H]([C@@H]2O)OC)O)OC(=O)C)[C@H](C[C@H]1O)OC
Standard InCHI	InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/p+1/t19-,20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,31+,32-,33+,34-/m1/s1
Standard InCHIKey	XFSBVAOIAHNAPC-NPVHKAFCSA-O
External Identifiers	ChEMBL [N/A]; PubChem [24832676];
Reference of Component-Ingredient Pair	18306748

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH222	Aconitum carmichaelii	Cao Wu	草乌
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC6329
Formula: C33H45NO11

Common Name	Mesaconitine
IUPAC Name	[(1S,2R,3R,4R,5R,6S,7S,8R,9R,10R,13R,14R,16S,17S,18R)-8-acetyloxy-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Canonical SMILES	COC[C@@]12C[NH+](C)[C@H]3[C@]4([C@@H]2[C@@H](OC)[C@@H]3[C@@]2([C@@H]3[C@H]4C[C@@]([C@@H]3OC(=O)c3ccccc3)([C@H]([C@@H]2O)OC)O)OC(=O)C)[C@H](C[C@H]1O)OC
Standard InCHI	InChI=1S/C33H45NO11/c1-16(35)45-33-21-18(13-31(39,28(43-6)26(33)37)27(21)44-29(38)17-10-8-7-9-11-17)32-20(41-4)12-19(36)30(15-40-3)14-34(2)25(32)22(33)23(42-5)24(30)32/h7-11,18-28,36-37,39H,12-15H2,1-6H3/p+1/t18-,19-,20+,21-,22+,23+,24-,25-,26+,27-,28+,30+,31-,32+,33-/m1/s1
Standard InCHIKey	XUHJBXVYNBQQBD-GQPWXMLZSA-O
External Identifiers	ChEMBL [N/A]; PubChem [16401314];
Reference of Component-Ingredient Pair	23947129

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC5703
Formula: C23H37NO5

Common Name	Isotalatizidine
IUPAC Name	(1S,2R,3R,4S,5S,6S,8S,9S,10R,13S,16S,17R)-11-ethyl-6-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
Canonical SMILES	COC[C@]12CC[C@@H]([C@@]34[C@@H]2C[C@@H]([C@H]3[NH+](C1)CC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2O)[C@H](C1)OC)O)O
Standard InCHI	InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/p+1/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1
Standard InCHIKey	RBSZCNOWHDHRFZ-VHNKBEDGSA-O
External Identifiers	ChEMBL [N/A]; PubChem [11452543];
Reference of Component-Ingredient Pair	28033733

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC49
Formula: C10H13NO2

Common Name	(1S)-1-Methyl-1,2,3,4-Tetrahydroisoquinoline-6,7-Diol
IUPAC Name	(1S)-1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Canonical SMILES	C[C@@H]1NCCc2c1cc(O)c(c2)O
Standard InCHI	InChI=1S/C10H13NO2/c1-6-8-5-10(13)9(12)4-7(8)2-3-11-6/h4-6,11-13H,2-3H2,1H3/t6-/m0/s1
Standard InCHIKey	IBRKLUSXDYATLG-LURJTMIESA-N
External Identifiers	ChEMBL [CHEMBL1195032]; PubChem [91588];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH2215	Ficus simplicissima	Wu Zhi Mao Tao	五指毛桃
TCMH920	Quercus dentata	Hu Ye Gan Jin Gao	槲叶干浸膏
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块

Ingredient ID: TCMC486
Formula: C6H7NO

Common Name	4-Aminophenol
IUPAC Name	4-azaniumylphenolate
Canonical SMILES	Nc1ccc(cc1)O
Standard InCHI	InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2
Standard InCHIKey	PLIKAWJENQZMHA-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1142]; PubChem [13283155];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块

Ingredient ID: TCMC437
Formula: C6H7NO

Common Name	3-Aminophenol
IUPAC Name	3-aminophenol
Canonical SMILES	Nc1cccc(c1)O
Standard InCHI	InChI=1S/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H2
Standard InCHIKey	CWLKGDAVCFYWJK-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL269755]; PubChem [11568];
Reference of Component-Ingredient Pair	22302165

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块

Ingredient ID: TCMC3826
Formula: C16H17NO3

Common Name	Demethylcoclaurine
IUPAC Name	(1R)-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Canonical SMILES	Oc1ccc(cc1)C[C@H]1[NH2+]CCc2c1cc(O)c(c2)O
Standard InCHI	InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2/p+1/t14-/m1/s1
Standard InCHIKey	WZRCQWQRFZITDX-CQSZACIVSA-O
External Identifiers	ChEMBL [CHEMBL501778]; PubChem [440988];
Reference of Component-Ingredient Pair	18556200

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH1275	Nelumbo nucifera	Lian Zi	莲子

Ingredient ID: TCMC2842
Formula: C6H7NO

Common Name	P-Aminophenol
IUPAC Name	4-aminophenol
Canonical SMILES	Nc1ccc(cc1)O
Standard InCHI	InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2
Standard InCHIKey	PLIKAWJENQZMHA-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1142]; PubChem [403];
Reference of Component-Ingredient Pair	29968805

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH623	Aconitum carmichaeli	Fu Zi	附子

Ingredient ID: TCMC2545
Formula: C6H7NO

Common Name	O-Phenylhydroxylamine
IUPAC Name	O-phenylhydroxylamine
Canonical SMILES	NOc1ccccc1
Standard InCHI	InChI=1S/C6H7NO/c7-8-6-4-2-1-3-5-6/h1-5H,7H2
Standard InCHIKey	UOKZUTXLHRTLFH-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL1213940]; PubChem [2794249];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块

Ingredient ID: TCMC226
Formula: C16H17NO3

Common Name	1-(4-Hydroxy-Benzyl)-1,2,3,4-Tetrahydro-Isoquinoline-6,7-Diol
IUPAC Name	1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol
Canonical SMILES	Oc1ccc(cc1)CC1NCCc2c1cc(O)c(c2)O
Standard InCHI	InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2
Standard InCHIKey	WZRCQWQRFZITDX-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL19344]; PubChem [114840];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块
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

Ingredient ID: TCMC1988
Formula: C6H7NO

Common Name	Questiomycin B
IUPAC Name	2-aminophenol
Canonical SMILES	Nc1ccccc1O
Standard InCHI	InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
Standard InCHIKey	CDAWCLOXVUBKRW-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL28319]; PubChem [5801];
Reference of Component-Ingredient Pair	26795242

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块

Ingredient ID: TCMC1374
Formula: C6H12O6

Common Name	Inositol
IUPAC Name	n.a.
Canonical SMILES	O[C@@H]1[C@H](O)[C@H](O)[C@H]([C@@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-
Standard InCHIKey	CDAISMWEOUEBRE-GPIVLXJGSA-N
External Identifiers	ChEMBL [CHEMBL1222251]; PubChem [N/A];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH521	Typhonium giganteum	Du Jiao Lian	独角莲
TCMH457	Euphorbia humifusa	Di Mian Cao	地绵草
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH429	Swertia chinensis	Dang Yao	当药
TCMH1969	Aconitum carmichaeli	Shu Fu Pian	熟附片
TCMH2538	Zea mays	Yu Mi Xu	玉米须
TCMH2515	Papaver somniferum	Ying Su Ke	罂粟壳
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH1105	Trollius chinensis	Jin Lian Hua	金莲花
TCMH2286	Berberis julianae	Xiao Bo Gen	小檗根
TCMH1484	Apis cerana	Mi La	蜜蜡
TCMH1601	Nelumbo nucifera	Ou Pian	藕片
TCMH74	Patrinia villosa	Bai Jiang	败酱
TCMH1033	Centella asiatica	Ji Xue Cao	积雪草
TCMH1394	Capparis masaikai	Ma Bing Lang	马槟榔
TCMH1592	Origanum vulgare	Niu Zhi	牛至
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1714	Lonicera japonica	Ren Dong Teng	忍冬藤
TCMH13	Artemisia argyi	Ai Ye You	艾叶油
TCMH2509	Epimedium brevicornum	Yin Yang Huo Jin Gao	淫羊藿浸膏
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1128	Lonicera japonica	Jin Yin Hua Ti Qu Ye	金银花提取液
TCMH1734	Homo sapiens	Ren Zhong Bai	人中白
TCMH583	Apis cerana	Feng Mi	蜂蜜
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH399	Aconitum carmichaeli	Dan Fu Pian	淡附片
TCMH613	Aconitum carmichaeli	Fu Pian	附片
TCMH623	Aconitum carmichaeli	Fu Zi	附子
TCMH624	Aconitum carmichaeli	Fu Zi Ren	附子仁
TCMH1898	Aconitum carmichaeli	Sheng Fu Zi	生附子
TCMH1968	Aconitum carmichaeli	Shu Fu Kuai	熟附块
TCMH58	Typhonium giganteum	Bai Fu Zi	白附子
TCMH2507	Epimedium brevicornum	Yin Yang Huo	淫羊藿
TCMH2508	Epimedium brevicornum	Yin Yang Huo Gan Gao Fen	淫羊藿干膏粉
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
TCMH454	Euphorbia humifusa	Di Jin Cao	地锦草
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
TCMH1489	Papaver somniferum	Mi Ying Su Ke	蜜罂粟壳
TCMH2514	Papaver somniferum	Ying Su	罂粟

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC49	C10H13NO2	(1S)-1-Methyl-1,2,3,4-Tetrahydroisoquinoline-6,7-Diol	179.09	-1.0729	2.23	0.899	1	3	52.49	3	2	13	0
TCMC226	C16H17NO3	1-(4-Hydroxy-Benzyl)-1,2,3,4-Tetrahydro-Isoquinoline-6,7-Diol	271.12	-1.5221	2.78	2.146	1	4	72.72	5	3	20	0
TCMC437	C6H7NO	3-Aminophenol	109.05	-1.2102	1.9	0.803	1	2	46.25	2	1	8	0
TCMC486	C6H7NO	4-Aminophenol	109.05	-1.2102	1.9	0.803	1	2	46.25	2	1	8	0
TCMC1374	C6H12O6	Inositol	180.06	-3.0642	1.46	-1.458	6	6	121.38	6	1	12	1
TCMC1988	C6H7NO	Questiomycin B	109.05	-1.2102	1.9	1.232	1	2	46.25	2	1	8	0
TCMC2545	C6H7NO	O-Phenylhydroxylamine	109.05	-0.7496	1.9	1.534	0	1	35.25	2	1	8	0
TCMC2842	C6H7NO	P-Aminophenol	109.0527638	-1.2102	1.9	0.803	1	2	46.25	0	1	8	0
TCMC3826	C16H17NO3	Demethylcoclaurine	272.1286684	-2.5456	2.78	2.258	0	4	77.3	2	3	20	0
TCMC5703	C23H37NO5	Isotalatizidine	408.2749983	-4.7073	3.33	0.097	5	4	83.59	4	6	29	0
TCMC6329	C33H45NO11	Mesaconitine	632.3070863	-5.744	3.77	0.938	11	4	154.65	10	7	45	1
TCMC6611	C34H47NO11	Aconitine	646.3227367	-5.4936	3.88	1.361	11	4	154.65	11	7	46	2
TCMC6618	C22H35NO4	Carmichaeline	378.2644336	-4.0251	3.33	0.71	4	4	74.36	2	6	27	0
TCMC6844	C24H39NO5	Talatisamine	422.2906484	-4.2988	3.44	0.616	5	3	72.59	5	6	30	0
TCMC6855	C34H47NO10	Deoxyaconitine	630.3278217	-4.9205	3.99	2.391	10	3	134.42	11	7	45	1
TCMC6856	C33H47NO9	Neojiangyouaconitine	602.3329071	-4.8911	3.99	2.17	9	3	117.35	10	7	43	0
TCMC7002	C27H41NO8	Deltaline	508.2910426	-3.9342	3.44	0.603	8	2	97.12	6	7	36	0
TCMC7003	C22H33NO2	Denudatine	344.2589543	-2.7637	3.55	2.082	2	3	44.9	1	4	25	0
TCMC7011	C24H39NO6	Bullatine B	438.285563	-4.8719	3.33	-0.414	6	4	92.82	5	6	31	0
TCMC7015	C26H43NO7	Delphatine	482.3117777	-4.494	3.44	0.143	7	3	91.05	7	6	34	0
TCMC7041	C47H73NO10	Lipohypaconitine	812.5312726	-8.8387	5.42	9.618	10	3	134.42	24	7	58	2
TCMC7049	C26H41NO7	Bullatine C	480.2961277	-4.4928	3.44	0.326	7	3	98.89	7	6	34	0
TCMC7090	C33H45NO7	14-O-Cinnamoylneoline	568.3274278	-4.1416	4.21	4.31	7	3	98.89	9	7	41	0
TCMC7091	C32H45NO8	14-O-Anisoylneoline	572.3223424	-4.5545	3.99	1.995	7	3	108.12	9	7	41	0
TCMC7092	C33H47NO9	14-O-Veratroylneoline	602.3329071	-4.6063	3.99	1.551	7	3	117.35	10	7	43	0
TCMC7093	C49H77NO10	Lipo-14-O-Anisoylbikhaconine	840.5625727	-7.8738	5.64	9.994	9	2	123.42	26	7	60	2
TCMC7102	C25H39NO7	Deltamine	466.2804776	-4.3133	3.33	-0.137	7	3	91.05	4	7	33	0
TCMC7242	C35H49NO10	Crassicauline A	644.3434721	-4.206	4.1	2.344	9	2	123.42	12	7	46	1
TCMC7243	C35H49NO9	Vilmorrianine C	628.3485572	-3.7669	4.21	3.254	8	1	103.19	12	7	45	1
TCMC7248	C25H39NO7	Delbrunine	466.2804776	-4.6931	3.33	-0.359	7	3	91.05	5	7	33	0
TCMC7276	C33H45NO9	Isodelphinine	600.3172571	-4.7318	3.99	2.878	9	2	114.19	10	7	43	0

Download Data

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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: Aconitum carmichaeli 附子

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: TCMC7276

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7248

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7243

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7242

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7102

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7093

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7092

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7091

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7090

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7049

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7041

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7015

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7011

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7003

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7002

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6856

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6855

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6844

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6618

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6611

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6329

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5703

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC49

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC486

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC437

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3826

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2842

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2545

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC226

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1988