TCM-ID Component

Description of the Component

Component ID	TCMH834
Latin Name	Semen glycine max
English Name	Black bean
Chinese Pinyin Name	Hei Dou
中文名	黑豆
TCM Properties	Mild,Sweet
TCM Meridians	Spleen,Kidney
Therapeutic Class English
Therapeutic Class Chinese
Functions
Toxicity	NA
Geo-authentic habitats (道地产区)	NA
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAJ4675-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx611	Bu Bai Granules	补白颗粒
TCMF3963	Bu Shen Yang Xue Pills	补肾养血丸
TCMFx612	Bu Shen Yang Xue Pills	补肾养血丸
TCMFx2354	Decoction of Poria
TCMFx3731	Fo Shou Capsules	福寿胶囊
TCMFx28	Fu Fang Dian Ji Xue Teng Ointment	复方滇鸡血藤膏
TCMF3861	Fu Ke Hui Sheng Pills	妇科回生丸
TCMFx3932	Fu Ke Wu Jin Pills	妇科乌金丸
TCMF3599	Gan Shen An Syrup	肝肾安糖浆
TCMF745	Gu Xian Tablet	骨仙片
TCMF3532	Gu Xian Tablets	骨仙片
TCMF4319	He Luo Shu Gan Capsules	和络舒肝胶囊
TCMF4327	He Luo Shu Gan Tablets	和络舒肝片
TCMF4154	Jian Pi Bu Xue Infusion	健脾补血冲剂
TCMFx4159	Jian Pi Bu Xue Tablets	健脾补血片
TCMF6953	Jian Yan Ling	健延龄
TCMFx1962	Jixueteng Concentrated Decoction	鸡血藤膏
TCMF4198	Kang Shuai Ling Ointment	抗衰灵膏
TCMFx4318	Mao Ji Bu Xue Wine	毛鸡补血酒
TCMF4553	Mo Jia Qing Ning Pills	莫家清宁丸
TCMF5458	Qing Ning Pills	清宁丸
TCMF2525	Qingning Pills	清宁丸
TCMF1403	Qingning Pills	清宁丸
TCMF2532	Red Jujube and Black Bean Decoction
TCMFx1192	She Xiang Feng Shi Capsule	麝香风湿胶囊
TCMFx5099	She Xiang Feng Shi Capsules	麝香风湿胶囊
TCMFx6958	Shen Di Yi Shen Oral Liquid	参地益肾口服液
TCMFx3551	Shen Rong Gu Ben Huan Shao Pills	参茸固本还少丸
TCMFx699	Shen Yan Kang Fu Tablet	肾炎康复片
TCMFx5659	Sheng Fa Tablets	生发片
TCMFx5009	Shi Wu Zhi Qing Ning Pills	十五制清宁丸
TCMFx5508	Wei Xue Kang Syrup	维血康糖浆
TCMFx5199	Wu Fa Pills	乌发丸
TCMFx5254	Wu Jin Zhi Tong Pills	乌金止痛丸
TCMF6646	Yan Shou Tablets	延寿片
TCMF6794	Yang Rong Bai Cao Pills	养荣百草丸
TCMF6637	Yi Shen Qiang Shen Pills	益肾强身丸
TCMFx6170	Zhi Su Ning Tablets	痔速宁片

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name

Ingredient Structrues

Ingredient ID: TCMC7249
Formula: C48H78O19

Common Name	Soyasaponin A3
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9S,10R,12aS,14aR,14bR)-9,10-dihydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@@]2(C)CO)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)[C@H]([C@H]2O)O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C48H78O19/c1-20-27(51)29(53)33(57)40(62-20)66-35-30(54)28(52)23(18-49)63-41(35)67-36-32(56)31(55)34(39(60)61)65-42(36)64-26-12-13-45(5)24(46(26,6)19-50)11-14-48(8)25(45)10-9-21-22-17-43(2,3)37(58)38(59)44(22,4)15-16-47(21,48)7/h9,20,22-38,40-42,49-59H,10-19H2,1-8H3,(H,60,61)/p-1/t20-,22-,23+,24+,25+,26-,27-,28-,29+,30-,31-,32-,33+,34-,35+,36+,37-,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1
Standard InCHIKey	NQGDGFITHGCDAO-ULCPARNTSA-M
External Identifiers	ChEMBL [N/A]; PubChem [101987000];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根

Ingredient ID: TCMC7000
Formula: C21H22O5

Common Name	Glyceollin Iv
IUPAC Name	(6aS,11aS)-3-methoxy-2-(3-methylbut-2-enyl)-6,11a-dihydro-[1]benzofuro[3,2-c]chromene-6a,9-diol
Canonical SMILES	COc1cc2OC[C@@]3([C@H](c2cc1CC=C(C)C)Oc1c3ccc(c1)O)O
Standard InCHI	InChI=1S/C21H22O5/c1-12(2)4-5-13-8-15-18(10-17(13)24-3)25-11-21(23)16-7-6-14(22)9-19(16)26-20(15)21/h4,6-10,20,22-23H,5,11H2,1-3H3/t20-,21+/m0/s1
Standard InCHIKey	WOKIXZBYDPTMJD-LEWJYISDSA-N
External Identifiers	ChEMBL [N/A]; PubChem [92470518];
Reference of Component-Ingredient Pair	25296697

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC6987
Formula: C48H78O19

Common Name	Soyasaponin V
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@@]2(C)CO)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)C[C@H]2O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C48H78O19/c1-43(2)16-22-21-8-9-26-45(4)12-11-28(46(5,20-51)25(45)10-13-48(26,7)47(21,6)15-14-44(22,3)27(52)17-43)64-42-38(34(58)33(57)36(65-42)39(60)61)67-41-37(32(56)30(54)24(19-50)63-41)66-40-35(59)31(55)29(53)23(18-49)62-40/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/p-1/t22-,23+,24+,25+,26+,27+,28-,29+,30-,31-,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1
Standard InCHIKey	WFRQIKSNAYYUJZ-BKQVBUAGSA-M
External Identifiers	ChEMBL [N/A]; PubChem [91973815];
Reference of Component-Ingredient Pair	10423561

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC6753
Formula: C31H52O3

Common Name	Soyasapogenol D
IUPAC Name	(3S,4S,4aR,6aR,6bS,8aR,9R,14aR,14bR)-4-(hydroxymethyl)-9-methoxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,13,14,14a-tetradecahydropicen-3-ol
Canonical SMILES	CO[C@@H]1CC(C)(C)CC2=C3[C@](CC[C@@]12C)(C)[C@]1(C)CC[C@@H]2[C@]([C@H]1CC3)(C)CC[C@@H]([C@]2(C)CO)O
Standard InCHI	InChI=1S/C31H52O3/c1-26(2)17-21-20-9-10-23-28(4)13-12-24(33)29(5,19-32)22(28)11-14-31(23,7)30(20,6)16-15-27(21,3)25(18-26)34-8/h22-25,32-33H,9-19H2,1-8H3/t22-,23-,24+,25-,27-,28+,29-,30-,31-/m1/s1
Standard InCHIKey	JAQZKPHHLRTVCY-ZHRKTGFNSA-N
External Identifiers	ChEMBL [N/A]; PubChem [46173903];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC6464
Formula: C53H86O24

Common Name	Soyasaponin A2
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9S,10R,12aS,14aR,14bR)-9-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)CO[C@H]([C@@H]2O)O[C@@H]2[C@H](O)C(C)(C)C[C@@H]3[C@@]2(C)CC[C@@]2(C3=CC[C@H]3[C@@]2(C)CC[C@@H]2[C@]3(C)CC[C@@H]([C@]2(C)CO)O[C@@H]2O[C@H](C(=O)[O-])[C@H]([C@@H]([C@H]2O[C@@H]2O[C@H](CO)[C@@H]([C@@H]([C@H]2O)O)O)O)O)C)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C53H86O24/c1-48(2)16-22-21-8-9-27-50(4)12-11-28(73-47-40(34(63)33(62)39(75-47)43(68)69)76-46-36(65)32(61)30(59)25(18-55)72-46)51(5,20-56)26(50)10-13-53(27,7)52(21,6)15-14-49(22,3)42(41(48)67)77-44-37(66)38(23(57)19-70-44)74-45-35(64)31(60)29(58)24(17-54)71-45/h8,22-42,44-47,54-67H,9-20H2,1-7H3,(H,68,69)/p-1/t22-,23-,24+,25+,26+,27+,28-,29+,30-,31-,32-,33-,34-,35+,36+,37+,38-,39-,40+,41-,42+,44-,45-,46-,47+,49+,50-,51+,52+,53+/m0/s1
Standard InCHIKey	QSWYVJWAKZGGIL-HNZPYRTBSA-M
External Identifiers	ChEMBL [N/A]; PubChem [21626405];
Reference of Component-Ingredient Pair	7882322

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC6372
Formula: C20H18O5

Common Name	Hydroxyphaseollin
IUPAC Name	(2S,11S)-17,17-dimethyl-4,12,18-trioxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),5(10),6,8,14(19),15,20-heptaene-2,7-diol
Canonical SMILES	Oc1ccc2c(c1)OC[C@@]1([C@H]2Oc2c1ccc1c2C=CC(O1)(C)C)O
Standard InCHI	InChI=1S/C20H18O5/c1-19(2)8-7-12-15(25-19)6-5-14-17(12)24-18-13-4-3-11(21)9-16(13)23-10-20(14,18)22/h3-9,18,21-22H,10H2,1-2H3/t18-,20+/m0/s1
Standard InCHIKey	LPBAKOAUSJMTEN-AZUAARDMSA-N
External Identifiers	ChEMBL [N/A]; PubChem [21155923];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC6001
Formula: C30H48O3

Common Name	Soyasapogenol E
IUPAC Name	(4aR,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-3,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-4-one
Canonical SMILES	OC[C@@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(CC1=O)(C)C)C)C)C
Standard InCHI	InChI=1S/C30H48O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)24(33)17-25/h8,20-23,31-32H,9-18H2,1-7H3/t20-,21+,22+,23-,26+,27-,28+,29+,30+/m0/s1
Standard InCHIKey	FNRBOAGVUNHDIL-LMZUXBMISA-N
External Identifiers	ChEMBL [CHEMBL490989]; PubChem [13632872];
Reference of Component-Ingredient Pair	10552628

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC5959
Formula: C30H50O4

Common Name	Soyasapogenol A
IUPAC Name	(3R,4S,4aR,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol
Canonical SMILES	OC[C@@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC([C@H]([C@H]1O)O)(C)C)C)C)C
Standard InCHI	InChI=1S/C30H50O4/c1-25(2)16-19-18-8-9-21-27(4)12-11-22(32)28(5,17-31)20(27)10-13-30(21,7)29(18,6)15-14-26(19,3)24(34)23(25)33/h8,19-24,31-34H,9-17H2,1-7H3/t19-,20+,21+,22-,23-,24+,26+,27-,28+,29+,30+/m0/s1
Standard InCHIKey	CDDWAYFUFNQLRZ-KJVHGCRFSA-N
External Identifiers	ChEMBL [CHEMBL1762006]; PubChem [12442849];
Reference of Component-Ingredient Pair	12428942

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根

Ingredient ID: TCMC5448
Formula: C43H87NO5

Common Name	Soyasphingosine A
IUPAC Name	(2R)-2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]pentacosanamide
Canonical SMILES	CCCCCCCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)CO)O
Standard InCHI	InChI=1S/C43H87NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(47)43(49)44-39(38-45)42(48)40(46)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h39-42,45-48H,3-38H2,1-2H3,(H,44,49)/t39-,40+,41+,42-/m0/s1
Standard InCHIKey	YADUGDLSXPPFIP-YIEWKAQUSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10580558];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC5336
Formula: C42H85NO5

Common Name	Soyasphingosine B
IUPAC Name	(2R)-2-hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]tetracosanamide
Canonical SMILES	CCCCCCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@H]([C@@H]([C@@H](CCCCCCCCCCCCCC)O)O)CO)O
Standard InCHI	InChI=1S/C42H85NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h38-41,44-47H,3-37H2,1-2H3,(H,43,48)/t38-,39+,40+,41-/m0/s1
Standard InCHIKey	ZFUXWVVVWGWGPQ-QLLOZFISSA-N
External Identifiers	ChEMBL [N/A]; PubChem [10212035];
Reference of Component-Ingredient Pair	16261518

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC4591
Formula: C16H12O5

Common Name	Glycitein
IUPAC Name	7-hydroxy-3-(4-hydroxyphenyl)-6-methoxychromen-4-one
Canonical SMILES	COc1cc2c(cc1O)occ(c2=O)c1ccc(cc1)O
Standard InCHI	InChI=1S/C16H12O5/c1-20-15-6-11-14(7-13(15)18)21-8-12(16(11)19)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3
Standard InCHIKey	DXYUAIFZCFRPTH-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL513024]; PubChem [5317750];
Reference of Component-Ingredient Pair	22484990

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC4408
Formula: C28H48O

Common Name	Campesterol,M-Cresol
IUPAC Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES	O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CC[C@@H](C(C)C)C)C)C)C1)C
Standard InCHI	InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1
Standard InCHIKey	SGNBVLSWZMBQTH-ZRUUVFCLSA-N
External Identifiers	ChEMBL [CHEMBL485421]; PubChem [5283637];
Reference of Component-Ingredient Pair	28357621

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH949	Phellodendron amurense	Huang Bai	黄柏
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH700	Drynaria fortunei	Gu Sui Bu	骨碎补
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH986	Scutellaria baicalensis	Huang Qin	黄芩
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1845	Dioscorea batatas	Shan Yao	山药
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1797	Morus alba	Sang Ye	桑叶

Ingredient ID: TCMC4372
Formula: C20H16O5

Common Name	Sojagol
IUPAC Name	7-hydroxy-17,17-dimethyl-4,12,18-trioxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),5(10),6,8,14(19),20-heptaen-3-one
Canonical SMILES	Oc1ccc2c(c1)oc(=O)c1c2oc2c1ccc1c2CCC(O1)(C)C
Standard InCHI	InChI=1S/C20H16O5/c1-20(2)8-7-12-14(25-20)6-5-13-16-18(24-17(12)13)11-4-3-10(21)9-15(11)23-19(16)22/h3-6,9,21H,7-8H2,1-2H3
Standard InCHIKey	GSAVLDZAGYKJSO-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [5281809];
Reference of Component-Ingredient Pair	24493455

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC4331
Formula: C21H20O10

Common Name	Genistein 7-Glucoside
IUPAC Name	5-hydroxy-3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Canonical SMILES	OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)occ(c3=O)c2ccc(cc2)O)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C21H20O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-5-13(24)16-14(6-11)29-8-12(17(16)25)9-1-3-10(23)4-2-9/h1-6,8,15,18-24,26-28H,7H2/t15-,18-,19+,20-,21-/m1/s1
Standard InCHIKey	ZCOLJUOHXJRHDI-CMWLGVBASA-N
External Identifiers	ChEMBL [CHEMBL486625]; PubChem [5281377];
Reference of Component-Ingredient Pair	27019979

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH677	Pueraria lobata	Ge Gen	葛根
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH938	Sophora japonica	Huai Hua	槐花

Ingredient ID: TCMC4324
Formula: C29H48O

Common Name	Stigmasterol
IUPAC Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES	CC[C@H](C(C)C)/C=C/[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
Standard InCHI	InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21+,23+,24+,25-,26+,27+,28+,29-/m1/s1
Standard InCHIKey	HCXVJBMSMIARIN-KEJCWXRGSA-N
External Identifiers	ChEMBL [CHEMBL400247]; PubChem [5281330];
Reference of Component-Ingredient Pair	24242815

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH389	Gleditsiae sinensis fructus	Da Zao Jiao	大皂角
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH228	Bupleurum chinense	Chai Hu	柴胡
TCMH407	Salvia miltiorrhiza	Dan Shen	丹参
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH536	Centipeda minima	E Bu Shi Cao	鹅不食草
TCMH206	Fructus xanthii sibirici	Cang Er Zi	苍耳子
TCMH62	Lilium brownii	Bai He	百合
TCMH421	Angelica sinensis	Dang Gui	当归
TCMH90	Imperata cylindrica	Bai Mao Gen	白茅根
TCMH241	Plantago asiatica	Che Qian Zi	车前子
TCMH426	Codonopsis pilosula	Dang Shen	党参
TCMH449	Cortex lycii radicis	Di Gu Pi	地骨皮
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH193	Psoralea corylifolia	Bu Gu Zhi	补骨脂
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH700	Drynaria fortunei	Gu Sui Bu	骨碎补
TCMH776	Piper kadsura	Hai Feng Teng	海风藤
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH1376	Trachelospermum jasminoides	Luo Shi Teng	络石藤
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH986	Scutellaria baicalensis	Huang Qin	黄芩
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1499	Changium smyrnioides	Ming Dang Shen	明党参
TCMH1423	Ophiopogon japonicus	Mai Dong	麦冬
TCMH1845	Dioscorea batatas	Shan Yao	山药
TCMH1768	Panax notoginseng	San Qi	三七
TCMH1680	Sinomenium acutum	Qing Feng Teng	青风藤
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH2238	Siegesbeckiae herba	Xi Xian Cao	豨莶草
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香
TCMH2297	Cirsium setosum	Xiao Ji	小蓟

Ingredient ID: TCMC4247
Formula: C30H48O2

Common Name	Soyasapogenol C
IUPAC Name	(3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,12,12a,14,14a-dodecahydropicen-3-ol
Canonical SMILES	OC[C@@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C=C1)(C)C)C)C)C
Standard InCHI	InChI=1S/C30H48O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,14-15,21-24,31-32H,9-13,16-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1
Standard InCHIKey	VNGUCOGHCJHFID-FLZFTVBESA-N
External Identifiers	ChEMBL [N/A]; PubChem [3083637];
Reference of Component-Ingredient Pair	US7713942

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC4132
Formula: C6H6O6

Common Name	Cis-Aconitic Acid
IUPAC Name	(Z)-prop-1-ene-1,2,3-tricarboxylic acid
Canonical SMILES	[O-]C(=O)C/C(=C/C(=O)[O-])/C(=O)[O-]
Standard InCHI	InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/p-3/b3-1-
Standard InCHIKey	GTZCVFVGUGFEME-IWQZZHSRSA-K
External Identifiers	ChEMBL [CHEMBL347285]; PubChem [643757];
Reference of Component-Ingredient Pair	27469509

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC3966
Formula: C29H50O

Common Name	Sitosterol,Β-Sitosterol
IUPAC Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-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-ol
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
Standard InCHI	InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21+,23+,24+,25-,26+,27+,28+,29-/m1/s1
Standard InCHIKey	KZJWDPNRJALLNS-FBZNIEFRSA-N
External Identifiers	ChEMBL [CHEMBL221542]; PubChem [457801];
Reference of Component-Ingredient Pair	23115546

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH29	Croton tiglium	Ba Dou Shuang	巴豆霜
TCMH389	Gleditsiae sinensis fructus	Da Zao Jiao	大皂角
TCMH224	Thuja orientalis	Ce Bai Ye	侧柏叶
TCMH381	Isatis indigotica	Da Qing Ye	大青叶
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH287	Clematidis armandii caulis	Chuan Mu Tong	川木通
TCMH407	Salvia miltiorrhiza	Dan Shen	丹参
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH28	Croton tiglium	Ba Dou	巴豆
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH240	Plantago depressa	Che Qian Cao	车前草
TCMH294	Rhizoma dioscoreae nipponicae	Chuan Shan Long	穿山龙
TCMH121	Biota orientalis	Bai Zi Ren	柏子仁
TCMH241	Plantago asiatica	Che Qian Zi	车前子
TCMH524	Eucommia ulmoides	Du Zhong	杜仲
TCMH127	Isatis indigotica	Ban Lan Gen	板蓝根
TCMH562	Saposhnikovia divaricata	Fang Feng	防风
TCMH327	Eleutherococcus senticosus	Ci Wu Jia	刺五加
TCMH104	Paeonia lactiflora	Bai Shao	白芍
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH258	Paeonia obovata	Chi Shao	赤芍
TCMH430	Canavalia gladiata	Dao Dou	刀豆
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH385	Sargentodoxa cuneata	Da Xue Teng	大血藤
TCMH273	Fritillaria cirrhosa	Chuan Bei Mu	川贝母
TCMH677	Pueraria lobata	Ge Gen	葛根
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH949	Phellodendron amurense	Huang Bai	黄柏
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH628	Glycyrrhiza uralensis	Gan Cao	甘草
TCMH700	Drynaria fortunei	Gu Sui Bu	骨碎补
TCMH776	Piper kadsura	Hai Feng Teng	海风藤
TCMH819	Polygonum multiflorum	He Shou Wu	何首乌
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH761	Cinnamomum cassia	Gui Zhi	桂枝
TCMH1376	Trachelospermum jasminoides	Luo Shi Teng	络石藤
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH981	Astragalus membranaceus	Huang Qi	黄芪
TCMH1368	Apocyni veneti folium	Luo Bu Ma Ye	罗布麻叶
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH986	Scutellaria baicalensis	Huang Qin	黄芩
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH1359	Pyrola calliantha	Lu Xian Cao	鹿衔草
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1698	Semen celosiae	Qing Xiang Zi	青葙子
TCMH1906	Cimicifuga foetida	Sheng Ma	升麻
TCMH1740	Cistanche deserticola	Rou Cong Rong	肉苁蓉
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根
TCMH1617	Eriobotrya japonica thunb	Pi Pa Ye	枇杷叶
TCMH1953	Pyrrosia lingua	Shi Wei	石韦
TCMH1634	Typha angustata	Pu Huang	蒲黄
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH1845	Dioscorea batatas	Shan Yao	山药
TCMH1768	Panax notoginseng	San Qi	三七
TCMH1680	Sinomenium acutum	Qing Feng Teng	青风藤
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2090	Gastrodia elata	Tian Ma	天麻
TCMH2094	Arisaema consanguineum	Tian Nan Xing	天南星
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH2252	Agrimonia pilosa var. japonica	Xian He Cao	仙鹤草
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2343	Scrophularia ningpoensis	Xuan Shen	玄参
TCMH2684	Ardisia crenata	Zhu Sha Gen	朱砂根
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香
TCMH2297	Cirsium setosum	Xiao Ji	小蓟

Ingredient ID: TCMC3950
Formula: C21H21O12

Common Name	Delphinidin-3-Glucoside
IUPAC Name	(2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Canonical SMILES	OC[C@H]1O[C@@H](Oc2cc3c(O)cc(cc3[o+]c2c2cc(O)c(c(c2)O)O)O)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C21H21O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-30H,6H2/q+1/t15-,17-,18+,19-,21-/m1/s1
Standard InCHIKey	VWRDVFLIYXFVBQ-PEVLUNPASA-N
External Identifiers	ChEMBL [CHEMBL518846]; PubChem [443650];
Reference of Component-Ingredient Pair	29037704

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC3863
Formula: C59H96O29

Common Name	Soyasaponin A1
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9S,10R,12aS,14aR,14bR)-9-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@@]2(C)CO)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)[C@H]([C@H]2O[C@@H]2OC[C@@H]([C@@H]([C@H]2O)O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)O)O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C59H96O29/c1-54(2)16-23-22-8-9-29-56(4)12-11-30(83-53-45(38(72)37(71)43(85-53)48(77)78)87-52-44(36(70)33(67)27(19-62)82-52)86-51-40(74)35(69)32(66)26(18-61)81-51)57(5,21-63)28(56)10-13-59(29,7)58(22,6)15-14-55(23,3)47(46(54)76)88-49-41(75)42(24(64)20-79-49)84-50-39(73)34(68)31(65)25(17-60)80-50/h8,23-47,49-53,60-76H,9-21H2,1-7H3,(H,77,78)/p-1/t23-,24-,25+,26+,27+,28+,29+,30-,31+,32+,33-,34-,35-,36-,37-,38-,39+,40+,41+,42-,43-,44+,45+,46-,47+,49-,50-,51-,52-,53+,55+,56-,57+,58+,59+/m0/s1
Standard InCHIKey	XFXHYKZIZSNVSQ-TZRAUYBZSA-M
External Identifiers	ChEMBL [N/A]; PubChem [441950];
Reference of Component-Ingredient Pair	16503561

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆

Ingredient ID: TCMC3434
Formula: C48H78O18

Common Name	Soyasaponin I
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@@]2(C)CO)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)C[C@H]2O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)/p-1/t21-,23-,24+,25+,26+,27+,28-,29-,30-,31+,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1
Standard InCHIKey	PTDAHAWQAGSZDD-IOVCITQVSA-M
External Identifiers	ChEMBL [CHEMBL511016]; PubChem [122097];
Reference of Component-Ingredient Pair	17455466

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH1020	Abrus fruticulosus	Ji Gu Cao	鸡骨草
TCMH1215	Sophora flavescens	Ku Shen	苦参

Ingredient ID: TCMC3408
Formula: C30H50O3

Common Name	Soyasapogenol B
IUPAC Name	(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol
Canonical SMILES	OC[C@@]1(C)[C@@H](O)CC[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C[C@H]1O)(C)C)C)C)C
Standard InCHI	InChI=1S/C30H50O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)24(33)17-25/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21+,22+,23-,24+,26+,27-,28+,29+,30+/m0/s1
Standard InCHIKey	YOQAQNKGFOLRGT-UXXABWCISA-N
External Identifiers	ChEMBL [CHEMBL1762007]; PubChem [115012];
Reference of Component-Ingredient Pair	28771341

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC3408	C30H50O3	Soyasapogenol B	458.3759955	1.3478	4.43	8.336	3	3	60.69	1	5	33	1
TCMC3434	C48H78O18	Soyasaponin I	941.5109906	-3.9685	4.76	3.675	18	10	297.81	9	8	66	2
TCMC3863	C59H96O29	Soyasaponin A1	1267.595902	-8.0247	4.76	-1.522	29	17	476.34	15	10	88	3
TCMC3950	C21H21O12	Delphinidin-3-Glucoside	465.1033011	-4.2795	2.45	0.05	5	9	200.53	4	4	33	1
TCMC3966	C29H50O	Sitosterol,Β-Sitosterol	414.3861662	1.3	4.54	11.595	1	1	20.23	6	4	30	1
TCMC4132	C6H6O6	Cis-Aconitic Acid	170.9929628	-2.5525	1.46	-2.477	6	0	120.39	4	0	12	0
TCMC4247	C30H48O2	Soyasapogenol C	440.3654308	2.2639	4.54	9.931	2	2	40.46	1	5	32	1
TCMC4324	C29H48O	Stigmasterol	412.3705162	1.2566	4.54	11.071	1	1	20.23	5	4	30	1
TCMC4331	C21H20O10	Genistein 7-Glucoside	432.1056468	-3.6021	2.67	-0.228	9	6	156.91	4	4	31	1
TCMC4372	C20H16O5	Sojagol	336.0997736	0.0525	3.11	3.543	1	1	68.9	0	5	25	0
TCMC4408	C28H48O	Campesterol,M-Cresol	400.3705162	1.9762	4.43	11.026	1	1	20.23	5	4	29	1
TCMC4591	C16H12O5	Glycitein	284.0684735	-1.4467	2.67	1.066	4	2	66.76	2	3	21	0
TCMC5336	C42H85NO5	Soyasphingosine B	683.6427748	-12.4621	5.42	16.53	6	5	110.02	40	0	48	2
TCMC5448	C43H87NO5	Soyasphingosine A	697.6584249	-12.7501	5.53	17.099	6	5	110.02	41	0	49	2
TCMC5959	C30H50O4	Soyasapogenol A	474.3709101	0.7747	4.32	7.102	4	4	80.92	1	5	34	1
TCMC6001	C30H48O3	Soyasapogenol E	456.3603454	1.5671	4.43	7.729	3	2	57.53	1	5	33	1
TCMC6372	C20H18O5	Hydroxyphaseollin	338.1154237	-0.6447	3.11	2.285	1	2	68.15	0	5	25	0
TCMC6464	C53H86O24	Soyasaponin A2	1105.543079	-6.2778	4.65	0.015	24	14	397.19	12	9	77	3
TCMC6753	C31H52O3	Soyasapogenol D	472.3916455	2.0822	4.54	8.11	3	2	49.69	2	5	34	1
TCMC6987	C48H78O19	Soyasaponin V	957.5059052	-4.4685	4.65	2.972	19	11	318.04	10	8	67	2
TCMC7000	C21H22O5	Glyceollin Iv	354.1467238	0.2731	3.22	2.874	1	2	68.15	3	4	26	0
TCMC7249	C48H78O19	Soyasaponin A3	957.5059052	-4.5416	4.65	2.441	19	11	318.04	9	8	67	2

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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: Semen glycine max 黑豆

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: TCMC7249

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC7000

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6987

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6753

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6464

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6372

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6001

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5959

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5448

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC5336

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4591

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4408

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4372

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4331

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4324

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4247

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC4132

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3966

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3950

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3863

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3434

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3408

Occurrence of the ingredient across TCM components

Properties

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