TCM-ID Component

Description of the Component

Component ID	TCMH33
Latin Name	Illicium verum
English Name	Chinese star anise
Chinese Pinyin Name	Ba Jiao Hui Xiang
中文名	八角茴香
TCM Properties	Warm,Pungent
TCM Meridians	Spleen,Stomach,Liver,Kidney
Therapeutic Class English	For warming interior
Therapeutic Class Chinese	温里
Functions	dispel cold regulate the flow of qi and relieve pain
Toxicity	NA
Geo-authentic habitats (道地产区)	Guangxi Province
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAJ4138-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMF2963	An Yang Hu Gu Yao Wine	安阳虎骨药酒
TCMFx2960	Ba Jiao Hui Xiang Decoction	八角茴香水
TCMFx3059	Chan Ling Pills	产灵丸
TCMFx3330	Feng Shang Zhi Tong Ointment	风伤止痛膏
TCMFx4129	Hai Ma San Shen Pills	海马三肾丸
TCMFx1425	Huixiang Juhe Pills	茴香橘核丸
TCMFx2597	Huixiang Juhe Pills	茴香橘核丸
TCMFx5	Jiu Xiang Zhi Tong Pills	九香止痛丸
TCMFx7032	Long Hu Ren Dan	龙虎人丹
TCMFx4364	Nuan Qi Ointment	暖脐膏
TCMFx55	Nuan Qi Ointment	暖脐膏
TCMFx2508	Nuanqi Plaster	暖脐膏
TCMFx4801	Qi Xiang Zhi Tong Pills	七香止痛丸
TCMFx5920	San Ceng Hui Xiang Pills	三层茴香丸
TCMF5193	San Yu Shen Qu	三余神曲
TCMFx5737	Shang Shi Qu Tong Ointment	伤湿祛痛膏
TCMFx3622	Shen Rong San Bian Pills	参茸三鞭丸
TCMFx5040	Shi Xiang Nuan Qi Ointment	十香暖脐膏
TCMFx5028	Su He Pills	苏合丸
TCMFx2621	Suoyang Gujing Pills	锁阳固精丸
TCMFx1441	Suoyang Gujing Pills	锁阳固精丸
TCMFx5163	Tou Gu Zhen Feng Pills	透骨镇风丸
TCMFx5768	Wei Qi Tong Tablets	胃气痛片
TCMF6133	Yao Shen Ointment	腰肾膏
TCMFx6199	Yao Zhi Gan Lan Yan	药制橄榄盐
TCMFx6833	Zhang Zhou Shen Qu	漳州神曲

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT33	CYP3A4	Cytochrome P450 3A4	Oxidoreductase	P08684
TCMT81	ALOX12	Arachidonate 12-lipoxygenase	Oxidoreductase	P18054

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name

Ingredient Structrues

Ingredient ID: TCMC6681
Formula: C20H18O11

Common Name	Quercetin-3-Xyloside
IUPAC Name	3,5,7-trihydroxy-2-[4-hydroxy-3-[(2S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]chromen-4-one
Canonical SMILES	Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O[C@@H]1OC[C@H](C(C1O)O)O)O
Standard InCHI	InChI=1S/C20H18O11/c21-8-4-10(23)14-13(5-8)30-19(17(27)16(14)26)7-1-2-9(22)12(3-7)31-20-18(28)15(25)11(24)6-29-20/h1-5,11,15,18,20-25,27-28H,6H2/t11-,15?,18?,20+/m1/s1
Standard InCHIKey	OIIVLLGYOWZKFZ-LAGKCARBSA-N
External Identifiers	ChEMBL [N/A]; PubChem [44259228];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC6627
Formula: C15H24

Common Name	Α-Copaene
IUPAC Name	(1R,6S,7S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
Canonical SMILES	CC(C1CC[C@@]2([C@@H]3[C@H]1C2C(=CC3)C)C)C
Standard InCHI	InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11?,12-,13-,14?,15+/m0/s1
Standard InCHIKey	VLXDPFLIRFYIME-PLWLXLEKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [25245021];
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
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸

Ingredient ID: TCMC5965
Formula: C10H16

Common Name	4(10)-Thujene,Α-Thujene
IUPAC Name	(1S)-2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene
Canonical SMILES	CC1=CCC2([C@H]1C2)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/t9-,10?/m0/s1
Standard InCHIKey	KQAZVFVOEIRWHN-RGURZIINSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12444322];
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
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH1803	Amomum villosum	Sha Ren	砂仁

Ingredient ID: TCMC5955
Formula: C10H14O3

Common Name	1-(4'-Methoxyphenyl)-(1S,2S)-Propanediol
IUPAC Name	(1S,2S)-1-(4-methoxyphenyl)propane-1,2-diol
Canonical SMILES	COc1ccc(cc1)[C@@H]([C@@H](O)C)O
Standard InCHI	InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10+/m0/s1
Standard InCHIKey	MRDZSBVJWOXBRW-OIBJUYFYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12387012];
Reference of Component-Ingredient Pair	27169197

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

Ingredient ID: TCMC5635
Formula: C10H14O3

Common Name	1-(4'-Methoxyphenyl)-(1R,2R)-Propanediol
IUPAC Name	(1R,2R)-1-(4-methoxyphenyl)propane-1,2-diol
Canonical SMILES	COc1ccc(cc1)[C@H]([C@H](O)C)O
Standard InCHI	InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10+/m1/s1
Standard InCHIKey	MRDZSBVJWOXBRW-XCBNKYQSSA-N
External Identifiers	ChEMBL [N/A]; PubChem [11217615];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC5546
Formula: C16H24O8

Common Name	(1'S,2'S)-Anethole Glycol 2'-O-Β-D-Glucopyranoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(1S,2S)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]([C@H](c2ccc(cc2)OC)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C16H24O8/c1-8(12(18)9-3-5-10(22-2)6-4-9)23-16-15(21)14(20)13(19)11(7-17)24-16/h3-6,8,11-21H,7H2,1-2H3/t8-,11+,12+,13+,14-,15+,16+/m0/s1
Standard InCHIKey	JYWSARFDLXXOHT-QMTLHMFBSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10958868];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC5545
Formula: C16H24O8

Common Name	(1'R,2'R)-Anethole Glycol 2'-O-Β-D-Glucopyranoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(1R,2R)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	OC[C@H]1O[C@@H](O[C@@H]([C@@H](c2ccc(cc2)OC)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C16H24O8/c1-8(12(18)9-3-5-10(22-2)6-4-9)23-16-15(21)14(20)13(19)11(7-17)24-16/h3-6,8,11-21H,7H2,1-2H3/t8-,11-,12+,13-,14+,15-,16-/m1/s1
Standard InCHIKey	JYWSARFDLXXOHT-VYHCSFOGSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10958867];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC5451
Formula: C16H24O8

Common Name	1-(4'-Methoxyphenyl)-(1S,2R)-Propan-1-Ol 2-O-Β-D-Glucopyranoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(1S,2R)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	OC[C@H]1O[C@@H](O[C@@H]([C@H](c2ccc(cc2)OC)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C16H24O8/c1-8(12(18)9-3-5-10(22-2)6-4-9)23-16-15(21)14(20)13(19)11(7-17)24-16/h3-6,8,11-21H,7H2,1-2H3/t8-,11-,12-,13-,14+,15-,16-/m1/s1
Standard InCHIKey	JYWSARFDLXXOHT-GGWCFCNESA-N
External Identifiers	ChEMBL [N/A]; PubChem [10593533];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC5436
Formula: C16H24O8

Common Name	1-(4'-Methoxyphenyl)-(1R,2S)-Propan-1-Ol 2-O-Β-D-Glucopyranoside
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(1R,2S)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]([C@@H](c2ccc(cc2)OC)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C16H24O8/c1-8(12(18)9-3-5-10(22-2)6-4-9)23-16-15(21)14(20)13(19)11(7-17)24-16/h3-6,8,11-21H,7H2,1-2H3/t8-,11+,12-,13+,14-,15+,16+/m0/s1
Standard InCHIKey	JYWSARFDLXXOHT-IBAHWZRKSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10497611];
Reference of Component-Ingredient Pair	N/A

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

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: TCMC5227
Formula: C17H20O9

Common Name	Feruloylquinic Acid
IUPAC Name	(1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
Canonical SMILES	COc1cc(/C=C/C(=O)O[C@@H]2C[C@@](O)(C[C@H]([C@H]2O)O)C(=O)[O-])ccc1O
Standard InCHI	InChI=1S/C17H20O9/c1-25-12-6-9(2-4-10(12)18)3-5-14(20)26-13-8-17(24,16(22)23)7-11(19)15(13)21/h2-6,11,13,15,18-19,21,24H,7-8H2,1H3,(H,22,23)/p-1/b5-3+/t11-,13-,15-,17+/m1/s1
Standard InCHIKey	RAGZUCNPTLULOL-KJJWLSQTSA-M
External Identifiers	ChEMBL [CHEMBL3526659]; PubChem [9799386];
Reference of Component-Ingredient Pair	25172103

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

Ingredient ID: TCMC5226
Formula: C10H14O3

Common Name	1-(4'-Methoxyphenyl)-(1R,2S)-Propanediol
IUPAC Name	(1S,2R)-1-(4-methoxyphenyl)propane-1,2-diol
Canonical SMILES	COc1ccc(cc1)[C@@H]([C@H](O)C)O
Standard InCHI	InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10-/m1/s1
Standard InCHIKey	MRDZSBVJWOXBRW-GMSGAONNSA-N
External Identifiers	ChEMBL [N/A]; PubChem [9799167];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC5225
Formula: C10H14O3

Common Name	1-(4'-Methoxyphenyl)-(1S,2R)-Propanediol
IUPAC Name	(1R,2S)-1-(4-methoxyphenyl)propane-1,2-diol
Canonical SMILES	COc1ccc(cc1)[C@H]([C@@H](O)C)O
Standard InCHI	InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3/t7-,10-/m0/s1
Standard InCHIKey	MRDZSBVJWOXBRW-XVKPBYJWSA-N
External Identifiers	ChEMBL [CHEMBL553164]; PubChem [9799166];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC4522
Formula: C14H18O

Common Name	3,3-Dimethyl Allyl-P-Propenyl Phenyl Ether
IUPAC Name	1-(3-methylbut-2-enoxy)-4-[(E)-prop-1-enyl]benzene
Canonical SMILES	C/C=C/c1ccc(cc1)OCC=C(C)C
Standard InCHI	InChI=1S/C14H18O/c1-4-5-13-6-8-14(9-7-13)15-11-10-12(2)3/h4-10H,11H2,1-3H3/b5-4+
Standard InCHIKey	JGELFJUQMIUNOO-SNAWJCMRSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5316879];
Reference of Component-Ingredient Pair	N/A

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

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: 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: TCMC4115
Formula: C10H10O2

Common Name	P-Methoxycinnamaldehyde
IUPAC Name	(E)-3-(4-methoxyphenyl)prop-2-enal
Canonical SMILES	COc1ccc(cc1)/C=C/C=O
Standard InCHI	InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3/b3-2+
Standard InCHIKey	AXCXHFKZHDEKTP-NSCUHMNNSA-N
External Identifiers	ChEMBL [CHEMBL452173]; PubChem [641294];
Reference of Component-Ingredient Pair	24234523

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

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: TCMC3385
Formula: C15H26O

Common Name	Carotol
IUPAC Name	(3R)-6,8a-dimethyl-3-propan-2-yl-1,2,3,4,5,8-hexahydroazulen-3a-ol
Canonical SMILES	CC1=CCC2(C(CC1)(O)[C@H](CC2)C(C)C)C
Standard InCHI	InChI=1S/C15H26O/c1-11(2)13-7-9-14(4)8-5-12(3)6-10-15(13,14)16/h5,11,13,16H,6-10H2,1-4H3/t13-,14?,15?/m1/s1
Standard InCHIKey	XZYQCFABZDVOPN-WLYUNCDWSA-N
External Identifiers	ChEMBL [N/A]; PubChem [101679];
Reference of Component-Ingredient Pair	N/A

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

Ingredient ID: TCMC3324
Formula: C15H24

Common Name	Γ-Cadinene
IUPAC Name	(1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Canonical SMILES	CC1=C[C@H]2[C@H](CC1)C(=C)CC[C@@H]2C(C)C
Standard InCHI	InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13-15H,4-8H2,1-3H3/t13-,14-,15-/m1/s1
Standard InCHIKey	WRHGORWNJGOVQY-RBSFLKMASA-N
External Identifiers	ChEMBL [N/A]; PubChem [92313];
Reference of Component-Ingredient Pair	22239952

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
TCMH1803	Amomum villosum	Sha Ren	砂仁
TCMH925	Exocarpium citri grandis	Hua Ju Hong	化橘红
TCMH728	Pogostemon cablin	Guang Huo Xiang	广藿香

Ingredient ID: TCMC3318
Formula: C15H26O

Common Name	Elemol
IUPAC Name	2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol
Canonical SMILES	C=C[C@]1(C)CC[C@H](C[C@H]1C(=C)C)C(O)(C)C
Standard InCHI	InChI=1S/C15H26O/c1-7-15(6)9-8-12(14(4,5)16)10-13(15)11(2)3/h7,12-13,16H,1-2,8-10H2,3-6H3/t12-,13+,15-/m1/s1
Standard InCHIKey	GFJIQNADMLPFOW-VNHYZAJKSA-N
External Identifiers	ChEMBL [CHEMBL2287241]; PubChem [92138];
Reference of Component-Ingredient Pair	26744017

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH211	Atractylodes lancea	Cang Zhu	苍术
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1903	Zingiber officinale	Sheng Jiang	生姜

Ingredient ID: TCMC3295
Formula: C15H24

Common Name	Α-Bergamotene
IUPAC Name	2,6-dimethyl-6-(4-methylpent-3-enyl)bicyclo[3.1.1]hept-2-ene
Canonical SMILES	CC(=CCCC1(C)C2CC=C(C1C2)C)C
Standard InCHI	InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3
Standard InCHIKey	YMBFCQPIMVLNIU-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [86608];
Reference of Component-Ingredient Pair	22224305

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
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶

Ingredient ID: TCMC3208
Formula: C15H26O

Common Name	Cedrol,Eudesmol,Α-Cedrol
IUPAC Name	(1S,2R,5S,7R,8R)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undecan-8-ol
Canonical SMILES	C[C@@H]1CC[C@@H]2[C@@]31CC[C@@]([C@H](C3)C2(C)C)(C)O
Standard InCHI	InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)12-9-15(10,11)8-7-14(12,4)16/h10-12,16H,5-9H2,1-4H3/t10-,11+,12-,14-,15+/m1/s1
Standard InCHIKey	SVURIXNDRWRAFU-OGMFBOKVSA-N
External Identifiers	ChEMBL [CHEMBL1974890]; PubChem [65575];
Reference of Component-Ingredient Pair	22818358

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH144	Herba artemisiae anomalae	Bei Liu Ji Nu	北刘寄奴
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH121	Biota orientalis	Bai Zi Ren	柏子仁
TCMH120	Atractylodes macrocephala	Bai Zhu	白术
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH797	Sargassum	Hai Zao	海藻
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1721	Panax ginseng	Ren Shen	人参

Ingredient ID: TCMC3162
Formula: C10H12O2

Common Name	Anisolacetone,Xanthotoxin , 8-Methoxypsoralen
IUPAC Name	1-(4-methoxyphenyl)propan-2-one
Canonical SMILES	COc1ccc(cc1)CC(=O)C
Standard InCHI	InChI=1S/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3
Standard InCHIKey	WFWKNGZODAOLEO-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL473366]; PubChem [31231];
Reference of Component-Ingredient Pair	15255718

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
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香

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: 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: TCMC2912
Formula: C15H24

Common Name	Β-Guaiene
IUPAC Name	1,4-dimethyl-7-propan-2-ylidene-2,3,4,5,6,8-hexahydro-1H-azulene
Canonical SMILES	CC(=C1CCC(C2=C(C1)C(C)CC2)C)C
Standard InCHI	InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3
Standard InCHIKey	GIBQERSGRNPMEH-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [6949];
Reference of Component-Ingredient Pair	20959422

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

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: TCMC280
Formula: C10H12O

Common Name	1-Methoxy-4-[(Z)-Prop-1-Enyl]Benzene
IUPAC Name	1-methoxy-4-[(Z)-prop-1-enyl]benzene
Canonical SMILES	C/C=Cc1ccc(cc1)OC
Standard InCHI	InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3-
Standard InCHIKey	RUVINXPYWBROJD-ARJAWSKDSA-N
External Identifiers	ChEMBL [CHEMBL1468832]; PubChem [1549040];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH1746	Cinnamomum cassia	Rou Gui Zi	肉桂子
TCMH1063	Curcuma longa	Jiang Huang	姜黄
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH730	Folium pogostemonis	Guang Huo Xiang Ye	广藿香叶
TCMH2137	Pogostemon cablin	Tu Huo Xiang	土藿香
TCMH731	Oleum pogostemonis	Guang Huo Xiang You	广藿香油
TCMH1374	Ocimum basilicum	Luo Le	罗勒
TCMH2706	Lithospermum erythrorhizon	Zi Cao	紫草
TCMH2728	Aster tataricus	Zi Wan	紫菀
TCMH2589	Cinnamomum camphora	Zhang Shu Zi	樟树子
TCMH685	Syzygium aromaticum	Gong Ding Xiang	公丁香
TCMH1744	Oleum cinnamomi	Rou Gui Ye	肉桂叶
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH132	Scutellaria barbata	Ban Zhi Lian	半枝莲
TCMH2180	Ficus carica	Wu Hua Guo	无花果
TCMH2135	Glycyrrhiza uralensis	Tu Gan Cao	土甘草
TCMH2315	Arnebia euchroma	Xin Jiang Zi Cao	新疆紫草
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH1158	Ocimum basilicum	Jiu Ceng Ta	九层塔
TCMH1290	Ocimum basilicum	Ling Ling Xiang	零陵香
TCMH309	Curcuma longa	Chuan Yu Jin	川郁金
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
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
TCMH716	Cinnamomum cassia	Guan Gui	官桂
TCMH761	Cinnamomum cassia	Gui Zhi	桂枝
TCMH1742	Cinnamomum cassia	Rou Gui	肉桂
TCMH486	Syzygium aromaticum	Ding Xiang	丁香
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
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

Ingredient ID: TCMC1134
Formula: C10H12O

Common Name	Estragole
IUPAC Name	1-methoxy-4-prop-2-enylbenzene
Canonical SMILES	COc1ccc(cc1)CC=C
Standard InCHI	InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
Standard InCHIKey	ZFMSMUAANRJZFM-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL470671]; PubChem [8815];
Reference of Component-Ingredient Pair	29191726

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH4	Ferula assafoetida	A Wei	阿魏
TCMH924	Zanthoxylum bungeanum	Hua Jiao	花椒
TCMH2630	Citrus aurantium	Zhi Shi	枳实
TCMH1656	Angelica decursiva	Qian Hu	前胡
TCMH695	Uncaria rhynchophylla	Gou Teng	钩藤
TCMH143	Albizia julibrissin	Bei He Huan	北合欢
TCMH730	Folium pogostemonis	Guang Huo Xiang Ye	广藿香叶
TCMH2137	Pogostemon cablin	Tu Huo Xiang	土藿香
TCMH731	Oleum pogostemonis	Guang Huo Xiang You	广藿香油
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH1212	Melia azedarach	Ku Lian Zi	苦楝子
TCMH2556	Polygala tenuifolia	Yuan Zhi Liu Jin Gao	远志流浸膏
TCMH2710	Homo sapiens	Zi He Che	紫河车
TCMH2239	Asarum sieboldii	Xi Xin	细辛
TCMH2200	Firmiana simplex	Wu Tong Ye Jin Gao	梧桐叶浸膏
TCMH1518	Chaenomeles sinensis	Mu Gua	木瓜
TCMH661	Euphorbia kansui	Gan Sui	甘遂
TCMH223	Platycladus orientalis	Ce Bai Tan	侧柏炭
TCMH1000	Foeniculum vulgare	Hui Xiang	茴香
TCMH447	Illicium difengpi	Di Feng Pi	地枫皮
TCMH1880	Moschus moschiferus	She Xiang	麝香
TCMH1272	Forsythia suspensa	Lian Qiao	连翘
TCMH1970	Pericarpium zanthoxyli	Shu Jiao	蜀椒
TCMH203	Acorus calamus	Cang Chang Pu	藏菖蒲
TCMH2180	Ficus carica	Wu Hua Guo	无花果
TCMH2135	Glycyrrhiza uralensis	Tu Gan Cao	土甘草
TCMH33	Illicium verum	Ba Jiao Hui Xiang	八角茴香
TCMH2553	Scrophularia ningpoensis	Yuan Shen	元参
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
TCMH1462	Moschus moschiferus	Mao She Xiang	毛麝香
TCMH1463	Moschus moschiferus	Mao She Xiang Jin Gao	毛麝香浸膏
TCMH1717	Moschus moschiferus	Ren Gong She Xiang	人工麝香
TCMH2554	Polygala tenuifolia	Yuan Zhi	远志
TCMH2555	Polygala tenuifolia	Yuan Zhi Jin Gao	远志浸膏
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
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
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
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
TCMC280	C10H12O	1-Methoxy-4-[(Z)-Prop-1-Enyl]Benzene	148.09	0.8555	2.45	3.979	0	0	9.23	4	1	11	0
TCMC1134	C10H12O	Estragole	148.09	0.9769	2.45	3.658	0	0	9.23	4	1	11	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
TCMC2912	C15H24	Β-Guaiene	204.1878008	2.7962	3.11	4.984	0	0	0	0	2	15	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
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
TCMC3162	C10H12O2	Anisolacetone,Xanthotoxin , 8-Methoxypsoralen	164.0837296	-0.2709	2.34	1.846	1	0	26.3	3	1	12	0
TCMC3208	C15H26O	Cedrol,Eudesmol,Α-Cedrol	222.1983655	1.3573	3	5.176	1	1	20.23	0	3	16	1
TCMC3295	C15H24	Α-Bergamotene	204.1878008	2.7484	3.11	6.104	0	0	0	3	1	15	1
TCMC3318	C15H26O	Elemol	222.1983655	2.2108	3	4.711	1	1	20.23	3	1	16	0
TCMC3324	C15H24	Γ-Cadinene	204.1878008	2.2603	3.11	5.942	0	0	0	1	2	15	1
TCMC3385	C15H26O	Carotol	222.1983655	1.6652	3	3.945	1	1	20.23	1	2	16	0
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
TCMC4115	C10H10O2	P-Methoxycinnamaldehyde	162.0680796	0.1169	2.34	2.486	1	0	26.3	3	1	12	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
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
TCMC4522	C14H18O	3,3-Dimethyl Allyl-P-Propenyl Phenyl Ether	202.1357652	2.321	2.89	5.18	0	0	9.23	4	1	15	1
TCMC5225	C10H14O3	1-(4'-Methoxyphenyl)-(1S,2R)-Propanediol	182.0942943	-1.0219	2.23	1.12	2	2	49.69	3	1	13	0
TCMC5226	C10H14O3	1-(4'-Methoxyphenyl)-(1R,2S)-Propanediol	182.0942943	-1.0219	2.23	1.12	2	2	49.69	3	1	13	0
TCMC5227	C17H20O9	Feruloylquinic Acid	367.1029072	-2.4655	2.34	-0.838	7	4	156.58	6	2	26	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
TCMC5436	C16H24O8	1-(4'-Methoxyphenyl)-(1R,2S)-Propan-1-Ol 2-O-Β-D-Glucopyranoside	344.1471177	-2.7688	2.34	0.012	7	5	128.84	6	2	24	0
TCMC5451	C16H24O8	1-(4'-Methoxyphenyl)-(1S,2R)-Propan-1-Ol 2-O-Β-D-Glucopyranoside	344.1471177	-2.7688	2.34	0.012	7	5	128.84	6	2	24	0
TCMC5545	C16H24O8	(1'R,2'R)-Anethole Glycol 2'-O-Β-D-Glucopyranoside	344.1471177	-2.7688	2.34	0.012	7	5	128.84	6	2	24	0
TCMC5546	C16H24O8	(1'S,2'S)-Anethole Glycol 2'-O-Β-D-Glucopyranoside	344.1471177	-2.7688	2.34	0.012	7	5	128.84	6	2	24	0
TCMC5635	C10H14O3	1-(4'-Methoxyphenyl)-(1R,2R)-Propanediol	182.0942943	-1.0219	2.23	1.12	2	2	49.69	3	1	13	0
TCMC5955	C10H14O3	1-(4'-Methoxyphenyl)-(1S,2S)-Propanediol	182.0942943	-1.0219	2.23	1.12	2	2	49.69	3	1	13	0
TCMC5965	C10H16	4(10)-Thujene,Α-Thujene	136.1252005	1.6288	2.56	4.177	0	0	0	1	2	10	0
TCMC6627	C15H24	Α-Copaene	204.1878008	1.7635	3.11	6.499	0	0	0	1	1	15	1
TCMC6681	C20H18O11	Quercetin-3-Xyloside	434.0849114	-3.6704	2.45	-0.218	6	7	177.14	3	4	31	1

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: Illicium verum 八角茴香

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: TCMC6681

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6627

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5965

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5955

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5635

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5546

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5545

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5451

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5436

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5325

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5227

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5226

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5225

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4522

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4338

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4336

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4115

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3886

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3385

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3324

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3318

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3295

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3208

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3162

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3150

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2931

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2930

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2912

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2901

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC280