Summary

Herb Id:  TCMCG012 Herb name:  Cicer arietinum
Function:  To clear heat and resolve toxin. Indication:  Diabetes mellitus.

Ingredient

Ingredient_name:   12-o-methylcoumestrol Alias:   NA
Ingredient_formula:   C16H10O5 Ingredient_Smile:   COC1=CC2=C(C=C1)C3=C(O2)C4=C(C=C(C=C4)O)OC3=O
Ingredient_weight:   282.25 g/mol OB_score:   NA
PubChem_id:  5319565 EC:  
1.14.14.90    [VIEW IN KEGG]
1.14.19.63    [VIEW IN KEGG]
Ingredient_name:   (+)-4''-o-methylcurine Alias:   NA
Ingredient_formula:   C37H40N2O6 Ingredient_Smile:   CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC(=C(C=C7)OC)O3)N(CCC6=CC(=C5O)OC)C)OC
Ingredient_weight:   NA OB_score:   NA
PubChem_id:  NA EC:  
-
Ingredient_name:   biochanin-7-glucoside Alias:   NA
Ingredient_formula:   C22H24O10 Ingredient_Smile:   COC1=CC=C(C=C1)C2COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O
Ingredient_weight:   NA OB_score:   NA
PubChem_id:  NA EC:  
-
Ingredient_name:   biochanin a Alias:   biochanin A anion; 7-hydroxy-3-(4-methoxyphenyl)-4-oxo-1-benzopyran-5-olate; CHEBI:58194; A827666; 3-(4-methoxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-5-olate; biochanin A(1-); 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-olate
Ingredient_formula:   C16H11O5- Ingredient_Smile:   COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)[O-])O
Ingredient_weight:   283.25 g/mol OB_score:   NA
PubChem_id:  25203224 EC:  
-
Ingredient_name:   daphnetin Alias:   4,8-Dihydroxycoumarin; AC-5538; ZINC21992842; 4,8-Dihydroxy-2H-chromen-2-one; BC216210; 7,8-dihydroxycoumarin; AKOS006290013; AK516453
Ingredient_formula:   C9H6O4 Ingredient_Smile:   C1=CC(=C(C2=C1C=CC(=O)O2)O)O
Ingredient_weight:   178.14 g/mol OB_score:   NA
PubChem_id:  5280569 EC:  
2.4.1.104    [VIEW IN KEGG]
2.5.1.138    [VIEW IN KEGG]
1.14.18.1    [VIEW IN KEGG]
Ingredient_name:   Daphnetin-8-glucoside Alias:   NP-002391; 7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-chromen-2-one; 7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one; Daphnetin glucoside; DTXSID40174971; MolPort-001-740-986; NCGC00380261-01!7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one; 7-hydroxy-8-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2-chromenone; FT-0697994; 7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-coumarin; 7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one; 2H-1-Benzopyran-2-one, 8-(beta-D-glucopyranosyloxy)-7-hydroxy-; 20853-56-9; AC1NSU5Y; MCULE-6518912539; ZINC31157928; daphnetin-8-glucoside; 7-HYDROXY-8-{[(2S,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}CHROMEN-2-ONE
Ingredient_formula:   C15H16O9 Ingredient_Smile:   C1=CC(=C(C2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)O
Ingredient_weight:   340.28 OB_score:   10.75697105
PubChem_id:  5316301 EC:  
2.4.1.104    [VIEW IN KEGG]
2.3.1.92    [VIEW IN KEGG]
Ingredient_name:   formononetin Alias:   Oprea1_815287; AIDS027672; 7-hydroxy-3-(4-methoxyphenyl)-4H-benzopyran-4-one; Isoflavone, 7-hydroxy-4'-methoxy- (8CI); NCI60_042081; NCGC00095207-03; Oprea1_139748; NCIOpen2_005983; SDCCGMLS-0066428.P001; CHEBI:18088; TNP00176; 485-72-3; Formononetol; Isoflavone, 7-hydroxy-4'-methoxy-; 7-hydroxy-3-(4-methoxyphenyl)chromone; Spectrum2_000560; Formononetin; NSC 93360; EINECS 207-623-9; 47752_FLUKA; KBio2_000853; 7-Hydroxy-3-(4-methoxyphenyl)-4-benzopyrone; Spectrum5_000258; KBio3_001519; NSC93360; KBioSS_000853; Spectrum_000373; SPECTRUM102007; KBio2_005989; Biochanin B; KBioGR_001878; NCGC00017269-01; 7-Hydroxy-3-(4′-methoxyphenyl)-4H-benzopyran-4-one; formononetin ; 7-hydroxy-4'-methoxy-isoflavone; BSPBio_002299; ZINC00113304; 4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-methoxyphenyl)- (9CI); SBB016445; Spectrum3_000660; 7-hydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one; Spectrum4_001429; DivK1c_006319; KBio2_003421; SPBio_000639; NCGC00095207-01; KBio1_001263; AIDS-027672; 7-Hydroxy-4'-methoxyisoflavone; C00858; 4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-methoxyphenyl)-; NCGC00095207-02; SpecPlus_000223
Ingredient_formula:   C16H12O4 Ingredient_Smile:   COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O
Ingredient_weight:   268.26 OB_score:   69.67388061
PubChem_id:  5280378 EC:  
1.14.14.88    [VIEW IN KEGG]
1.14.14.89    [VIEW IN KEGG]
1.14.14.90    [VIEW IN KEGG]
2.1.1.46    [VIEW IN KEGG]
2.4.1.170    [VIEW IN KEGG]
4.2.1.105    [VIEW IN KEGG]
2.1.1.150    [VIEW IN KEGG]
Ingredient_name:   formononetin-7-glucoside Alias:   NA
Ingredient_formula:   C22H22O9 Ingredient_Smile:   COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O
Ingredient_weight:   430.4 g/mol OB_score:   NA
PubChem_id:  71541772 EC:  
2.3.1.115    [VIEW IN KEGG]
2.4.1.170    [VIEW IN KEGG]
Ingredient_name:   Garbanzol Alias:   1226-22-8; SCHEMBL9663852; (2R,3R)-3,7-dihydroxy-2-(4-hydroxyphenyl)-4-chromanone; AC1MR5CU; C09751; (2R,3R)-3,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one; 3,7,4'-Trihydroxyflavanone; garbanzol; 3,7,4'-Trihydroxyflavanon; 3,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one; 3,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one; (2R,3R)-3,4',7-Trihydroxyflavanone
Ingredient_formula:   C15H12O5 Ingredient_Smile:   C1=CC(=CC=C1C2C(C(=O)C3=C(O2)C=C(C=C3)O)O)O
Ingredient_weight:   272.25 OB_score:   83.67004451
PubChem_id:  3512634 EC:  
1.1.1.234    [VIEW IN KEGG]
1.14.11.9    [VIEW IN KEGG]
1.14.14.81    [VIEW IN KEGG]
1.14.14.82    [VIEW IN KEGG]
1.14.14.87    [VIEW IN KEGG]
1.14.19.76    [VIEW IN KEGG]
1.14.20.5    [VIEW IN KEGG]
2.1.1.231    [VIEW IN KEGG]
2.1.1.232    [VIEW IN KEGG]
2.4.1.185    [VIEW IN KEGG]
2.5.1.70    [VIEW IN KEGG]
3.2.1.21    [VIEW IN KEGG]
5.5.1.6    [VIEW IN KEGG]
1.14.14.93    [VIEW IN KEGG]
2.5.1.36    [VIEW IN KEGG]
1.14.14.162    [VIEW IN KEGG]
2.1.1.65    [VIEW IN KEGG]
1.3.1.51    [VIEW IN KEGG]
1.21.3.6    [VIEW IN KEGG]
2.3.1.74    [VIEW IN KEGG]
2.4.1.286    [VIEW IN KEGG]
1.1.1.219    [VIEW IN KEGG]
1.14.20.6    [VIEW IN KEGG]
2.1.1.212    [VIEW IN KEGG]
4.2.1.105    [VIEW IN KEGG]
Ingredient_name:   garcinol Alias:   NA
Ingredient_formula:   C38H50O6 Ingredient_Smile:   CC(=CCC1CC2(C(=O)C(=C(C3=CC(=C(C=C3)O)O)O)C(=O)C(C2=O)(C1(C)C)CC=C(C)C)CC(CC=C(C)C)C(=C)C)C
Ingredient_weight:   602.8 g/mol OB_score:   NA
PubChem_id:  138111558 EC:  
-
Ingredient_name:   homoferreirin Alias:   NA
Ingredient_formula:   C17H16O6 Ingredient_Smile:   COC1=CC(=C(C=C1)C2COC3=CC(=CC(=C3C2=O)O)O)OC
Ingredient_weight:   316.3 g/mol OB_score:   NA
PubChem_id:  442788 EC:  
-
Ingredient_name:   homofukinolide Alias:   NA
Ingredient_formula:   C25H34O6 Ingredient_Smile:   CC=C(C)C(=O)OC1CCC(C2(C1C(C3(C2)C(=C)COC3=O)OC(=O)C(=CC)C)C)C
Ingredient_weight:   430.5 g/mol OB_score:   NA
PubChem_id:  131751601 EC:  
-
Ingredient_name:   isoliquiritigenin Alias:   HCC; KBio2_000625; SPBio_000949; Spectrum2_000875; 961-29-5; 2-PROPEN-1-ONE, 1-(2,4-DIHYDROXYPHENYL)-3-(4-HYDROXYPHENYL)-; SPECTRUM1504200; Chalcone, 2',4,4'-trihydroxy-; CHEMBL1395334; KBio3_002631; NCGC00015556-01; SDCCGMLS-0066751.P001; ST5309279; (2E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one; KBio2_003193; InChI=1/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3; (E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one; CMLD3_000056; BSPBio_003411; C08650; CCRIS 7676; 2',4,4'-Trihydroxychalcone; Lopac0_000681; 1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one; I159_SIGMA; 1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one; Lopac-I-3766; CPD-3041; KBio1_001802; MEGxp0_001326; ZINC3869607; BRN 1914295; MLS000438943; SMR000112969; Acrylophenone, 2',4'-dihydroxy-3-(p-hydroxyphenyl)-; (2E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one; ACon1_000047; GU 17; KBioGR_002232; DivK1c_006858; KBio2_005761; 1-08-00-00707 (Beilstein Handbook Reference); 4,2′,4′-Trihydroxychalcone; (E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one; NCGC00090504-01; (Z)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one; EU-0100681; Spectrum3_001656; AC1O7G44; 4,2',4'-Trihydroxychalcone; EINECS 237-316-5; I3766_SIGMA; AIDS035379; AIDS-035379; 13745-20-5; Spectrum5_000612; 2-propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-, (2E)-; Spectrum_000145; KBioSS_000625; Isoliquiritigenin; Spectrum4_001756; 42'4'-trihydroxychalcone; 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-, (E)-; NCGC00090504-03; SpecPlus_000762
Ingredient_formula:   C15H12O4 Ingredient_Smile:   C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2)O)O)O
Ingredient_weight:   256.25 OB_score:   85.32179823
PubChem_id:  638278 EC:  
1.14.14.93    [VIEW IN KEGG]
2.1.1.154    [VIEW IN KEGG]
2.3.1.170    [VIEW IN KEGG]
5.5.1.6    [VIEW IN KEGG]
1.14.11.9    [VIEW IN KEGG]
1.14.14.82    [VIEW IN KEGG]
1.14.14.87    [VIEW IN KEGG]
1.14.14.162    [VIEW IN KEGG]
1.14.19.76    [VIEW IN KEGG]
1.14.20.5    [VIEW IN KEGG]
1.14.14.81    [VIEW IN KEGG]
2.3.1.74    [VIEW IN KEGG]
Ingredient_name:   isoliquiritin Alias:   MolPort-001-742-630; 7014-39-3; 5041-81-6; 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-(beta-D-glucopyranosyloxy)phenyl)-, (2E)-; C16978; Q-100563; BDBM50362885; (E)-1-(2,4-dihydroxyphenyl)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]prop-2-en-1-one; SCHEMBL676338; 4-beta-D-glucopyranosyloxy-2',4'-dihydroxy-trans-chalcone; I07-0258; Isoliquiritin; X1193; 2Y348H1V4W; MEGxp0_001945; YNWXJFQOCHMPCK-LXGDFETPSA-N; CHEMBL599763; UNII-2Y348H1V4W; AKOS015897131; X1167; AC1NSX26; BG01706425; 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-[4-(.beta.-D-glucopyranosyloxy)phenyl]-, (2E)-; AK554321; AT-28971; 4-[(1E)-3-(2,4-dihydroxyphenyl)-3-oxoprop-1-en-1-yl]phenyl beta-D-glucopyranoside; N1750; (E)-1-(2,4-dihydroxyphenyl)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one; MFCD00272145; ZINC33832004; LMPK12120021; 4-(beta-D-Glucopyranosyloxy)-2',4'-dihydroxychalcone; AK544982; CHEBI:80839; Neoisoliquritin
Ingredient_formula:   C21H22O9 Ingredient_Smile:   C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O
Ingredient_weight:   418.4 g/mol OB_score:   NA
PubChem_id:  5318591 EC:  
-
Ingredient_name:   liquiritigenin Alias:   (2R)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one; N1793; AJ-23291; AC1LICLD; ZINC519174
Ingredient_formula:   C15H12O4 Ingredient_Smile:   C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC=C(C=C3)O
Ingredient_weight:   256.25 g/mol OB_score:   NA
PubChem_id:  114829 EC:  
1.14.14.93    [VIEW IN KEGG]
2.1.1.154    [VIEW IN KEGG]
2.3.1.170    [VIEW IN KEGG]
5.5.1.6    [VIEW IN KEGG]
1.14.11.9    [VIEW IN KEGG]
1.14.14.82    [VIEW IN KEGG]
1.14.14.87    [VIEW IN KEGG]
1.14.14.162    [VIEW IN KEGG]
1.14.19.76    [VIEW IN KEGG]
1.14.20.5    [VIEW IN KEGG]
1.14.14.81    [VIEW IN KEGG]
2.3.1.74    [VIEW IN KEGG]
Ingredient_name:   liquiritigenin-7-o-β-d-(3-o-acetyl)-apio-furanosyl-4'-o-β-d-glucopyranoside Alias:   liquiritigenin-7-o-beta-d-(3-o-acetyl)-apiofuranosyl-4'-o-beta-d-glucopyranoside
Ingredient_formula:   NA Ingredient_Smile:   Not Available
Ingredient_weight:   NA OB_score:   NA
PubChem_id:  NA EC:  
-
Ingredient_name:   medicagol Alias:   3-Hydroxy-6H-[1,3]dioxolo[5,6]benzofuro[3,2-c][1]-benzopyran-6-one, 9CI; UNII-5OBT39CCC9; BG01008083; AK687091; 16-HYDROXY-5,7,11,19-TETRAOXAPENTACYCLO[10.8.0.0(2),(1)?.0?,?.0(1)(3),(1)?]ICOSA-1(12),2(10),3,8,13(18),14,16-HEPTAEN-20-ONE; 5OBT39CCC9; 7-Hydroxy-11,12-methylenedioxycoumestan; Medicagol; 3-Hydroxy-8,9-methylenedioxycoumestan; LMPK12090025; SCHEMBL74591; CHEMBL99941; 1983-72-8; DTXSID10173557; 6H-(1,3)Dioxolo(5,6)benzofuro(3.2-c)(1)benzopyran-6-one, 3-hydroxy-; ZINC2561256; 7-Hydroxy-5',6'-methylenedioxybenzofurano[3',2':3,4]coumarin; AKOS032946033; 3-Hydroxy-6H-[1,3]dioxolo[4',5':5,6]benzofuro[3,2-c]chromen-6-one
Ingredient_formula:   C16H8O6 Ingredient_Smile:   C1OC2=C(O1)C=C3C(=C2)C4=C(O3)C5=C(C=C(C=C5)O)OC4=O
Ingredient_weight:   296.23 g/mol OB_score:   NA
PubChem_id:  5319322 EC:  
-
Ingredient_name:   (-)-medicarpin Alias:   NA
Ingredient_formula:   C16H14O4 Ingredient_Smile:   COC1=CC2=C(C=C1)C3COC4=C(C3O2)C=CC(=C4)O
Ingredient_weight:   270.28 g/mol OB_score:   NA
PubChem_id:  336327 EC:  
2.4.1.170    [VIEW IN KEGG]
4.2.1.139    [VIEW IN KEGG]
2.1.1.154    [VIEW IN KEGG]
Ingredient_name:   Pratensein Alias:   5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one; 5,7-Dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one; 2284-31-3; C10520; 3'-hydroxybiochanin A; pratensein; 5,7-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)chromone; 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-4-chromenone; 5,7-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)chromen-4-one; 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-
Ingredient_formula:   C16H12O6 Ingredient_Smile:   COC1=C(C=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O)O
Ingredient_weight:   300.26 OB_score:   39.06339634
PubChem_id:  5281803 EC:  
2.1.1.42    [VIEW IN KEGG]
2.1.1.76    [VIEW IN KEGG]
2.1.1.155    [VIEW IN KEGG]
1.14.14.88    [VIEW IN KEGG]
1.14.19.63    [VIEW IN KEGG]
1.3.1.45    [VIEW IN KEGG]
1.14.14.90    [VIEW IN KEGG]
2.1.1.270    [VIEW IN KEGG]
Ingredient_name:   Pratol Alias:   DTXSID20197587; AC1NSZS1; AN-829/40761415; SR-05000002252-2; NSC123414; 7-Hydroxy-4'-methoxyflavone; NSC-123414; 7-Hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one; 7-Hydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one; NCGC00142412-02; BDBM85573; UNII-KU5R959MO7; LS-39700; 7-hydroxy-2-(4-methoxyphenyl)-4-chromenone; Oprea1_854602; 4H-1-Benzopyran-4-one, 7-hydroxy-2-(4-methoxyphenyl)-; AIDS032471; CHEMBL16751; 487-17-2; C.I. 75570; C-57549; 7-hydroxy-2-(4-methoxyphenyl)chromen-4-one; 7-hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one; pratol; ZINC5733557; SQVXWIUVAILQRH-UHFFFAOYSA-N; 487-24-1; NCGC00017200-02; NSC 123414; AIDS-032471; EINECS 207-653-2; MolPort-002-903-705; 4'-methoxy-7-hydroxyflavone; 7-Hydroxy-flavone, 5h; FT-0730316; MFCD00016937; AK396434; NCGC00142412-01; Flavone, 7-hydroxy-4'-methoxy-; SCHEMBL534596; Flavone, 7-hydroxy-4'-methoxy- (7CI,8CI); AKOS004110700; 15W; 7-Hydroxy-2-(4-methoxyphenyl)-4-benzopyrone; CCG-208438; NCGC00017200-03; MCULE-4757451306; 7-Hydroxy-4-methoxyflavone; NCGC00017200-01; ST055366; BRN 0237239; ACM487172; TNP00065; 7-Hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one #; 7-hydroxy-2-(4-methoxyphenyl)chromone; MLS002707301; SR-05000002252; SMR001488172; ZINC00038940; 4hl5; KU5R959MO7
Ingredient_formula:   C16H12O4 Ingredient_Smile:   COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)O
Ingredient_weight:   268.26 OB_score:   20.04010534
PubChem_id:  5320693 EC:  
1.14.14.88    [VIEW IN KEGG]
1.14.14.89    [VIEW IN KEGG]
1.14.14.90    [VIEW IN KEGG]
2.1.1.46    [VIEW IN KEGG]
2.4.1.170    [VIEW IN KEGG]
4.2.1.105    [VIEW IN KEGG]
2.1.1.150    [VIEW IN KEGG]
Ingredient_name:   pyruvicacid Alias:   pyruvic acid; Pyruvic acid
Ingredient_formula:   C3H4O3 Ingredient_Smile:   CC(=O)C(=O)O
Ingredient_weight:   88.06 g/mol OB_score:   NA
PubChem_id:  1060 EC:  
1.1.1.27    [VIEW IN KEGG]
1.1.1.28    [VIEW IN KEGG]
1.1.1.38    [VIEW IN KEGG]
1.1.1.39    [VIEW IN KEGG]
1.1.1.40    [VIEW IN KEGG]
1.1.1.83    [VIEW IN KEGG]
1.1.2.3    [VIEW IN KEGG]
1.1.2.4    [VIEW IN KEGG]
1.1.2.5    [VIEW IN KEGG]
1.1.3.2    [VIEW IN KEGG]
1.1.5.12    [VIEW IN KEGG]
1.1.99.6    [VIEW IN KEGG]
1.1.99.7    [VIEW IN KEGG]
1.1.99.40    [VIEW IN KEGG]
1.2.1.22    [VIEW IN KEGG]
1.2.1.23    [VIEW IN KEGG]
1.2.1.49    [VIEW IN KEGG]
1.2.1.51    [VIEW IN KEGG]
1.2.1.104    [VIEW IN KEGG]
1.2.3.3    [VIEW IN KEGG]
1.2.3.6    [VIEW IN KEGG]
1.2.3.15    [VIEW IN KEGG]
1.2.4.1    [VIEW IN KEGG]
1.2.5.1    [VIEW IN KEGG]
1.2.7.1    [VIEW IN KEGG]
1.2.7.11    [VIEW IN KEGG]
1.3.1.110    [VIEW IN KEGG]
1.4.1.1    [VIEW IN KEGG]
1.4.1.17    [VIEW IN KEGG]
1.4.3.3    [VIEW IN KEGG]
1.4.3.19    [VIEW IN KEGG]
1.5.1.11    [VIEW IN KEGG]
1.5.1.16    [VIEW IN KEGG]
1.5.1.17    [VIEW IN KEGG]
1.5.1.22    [VIEW IN KEGG]
1.5.1.23    [VIEW IN KEGG]
1.5.1.24    [VIEW IN KEGG]
1.5.1.26    [VIEW IN KEGG]
1.5.1.28    [VIEW IN KEGG]
1.5.1.52    [VIEW IN KEGG]
1.14.11.43    [VIEW IN KEGG]
1.14.11.44    [VIEW IN KEGG]
2.1.3.1    [VIEW IN KEGG]
2.2.1.6    [VIEW IN KEGG]
2.2.1.7    [VIEW IN KEGG]
2.2.1.12    [VIEW IN KEGG]
2.3.1.54    [VIEW IN KEGG]
2.3.3.21    [VIEW IN KEGG]
2.6.1.2    [VIEW IN KEGG]
2.6.1.12    [VIEW IN KEGG]
2.6.1.15    [VIEW IN KEGG]
2.6.1.18    [VIEW IN KEGG]
2.6.1.21    [VIEW IN KEGG]
2.6.1.30    [VIEW IN KEGG]
2.6.1.37    [VIEW IN KEGG]
2.6.1.40    [VIEW IN KEGG]
2.6.1.41    [VIEW IN KEGG]
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2.6.1.44    [VIEW IN KEGG]
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2.6.1.51    [VIEW IN KEGG]
2.6.1.56    [VIEW IN KEGG]
2.6.1.58    [VIEW IN KEGG]
2.6.1.66    [VIEW IN KEGG]
2.6.1.71    [VIEW IN KEGG]
2.6.1.77    [VIEW IN KEGG]
2.6.1.84    [VIEW IN KEGG]
2.6.1.96    [VIEW IN KEGG]
2.6.1.99    [VIEW IN KEGG]
2.6.1.108    [VIEW IN KEGG]
2.6.1.113    [VIEW IN KEGG]
2.6.1.115    [VIEW IN KEGG]
2.6.1.119    [VIEW IN KEGG]
2.6.3.1    [VIEW IN KEGG]
2.7.1.40    [VIEW IN KEGG]
2.7.1.121    [VIEW IN KEGG]
2.7.3.9    [VIEW IN KEGG]
2.7.9.1    [VIEW IN KEGG]
2.7.9.2    [VIEW IN KEGG]
2.8.1.2    [VIEW IN KEGG]
3.1.3.60    [VIEW IN KEGG]
3.3.2.1    [VIEW IN KEGG]
3.3.2.13    [VIEW IN KEGG]
3.3.2.15    [VIEW IN KEGG]
3.5.99.10    [VIEW IN KEGG]
3.7.1.5    [VIEW IN KEGG]
3.7.1.6    [VIEW IN KEGG]
3.7.1.20    [VIEW IN KEGG]
3.7.1.23    [VIEW IN KEGG]
3.7.1.26    [VIEW IN KEGG]
3.11.1.3    [VIEW IN KEGG]
4.1.1.1    [VIEW IN KEGG]
4.1.1.64    [VIEW IN KEGG]
4.1.1.78    [VIEW IN KEGG]
4.1.1.112    [VIEW IN KEGG]
4.1.2.14    [VIEW IN KEGG]
4.1.2.18    [VIEW IN KEGG]
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4.1.2.21    [VIEW IN KEGG]
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4.1.2.28    [VIEW IN KEGG]
4.1.2.34    [VIEW IN KEGG]
4.1.2.45    [VIEW IN KEGG]
4.1.2.51    [VIEW IN KEGG]
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4.1.2.54    [VIEW IN KEGG]
4.1.2.55    [VIEW IN KEGG]
4.1.2.58    [VIEW IN KEGG]
4.1.3.3    [VIEW IN KEGG]
4.1.3.16    [VIEW IN KEGG]
4.1.3.17    [VIEW IN KEGG]
4.1.3.22    [VIEW IN KEGG]
4.1.3.25    [VIEW IN KEGG]
4.1.3.27    [VIEW IN KEGG]
4.1.3.30    [VIEW IN KEGG]
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4.1.3.40    [VIEW IN KEGG]
4.1.3.42    [VIEW IN KEGG]
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4.1.3.44    [VIEW IN KEGG]
4.1.3.45    [VIEW IN KEGG]
4.1.3.46    [VIEW IN KEGG]
4.1.99.1    [VIEW IN KEGG]
4.1.99.2    [VIEW IN KEGG]
4.2.99.20    [VIEW IN KEGG]
4.2.99.21    [VIEW IN KEGG]
4.3.1.10    [VIEW IN KEGG]
4.3.1.13    [VIEW IN KEGG]
4.3.1.15    [VIEW IN KEGG]
4.3.1.17    [VIEW IN KEGG]
4.3.1.18    [VIEW IN KEGG]
4.3.1.19    [VIEW IN KEGG]
4.3.3.7    [VIEW IN KEGG]
4.4.1.1    [VIEW IN KEGG]
4.4.1.13    [VIEW IN KEGG]
4.4.1.15    [VIEW IN KEGG]
4.4.1.24    [VIEW IN KEGG]
4.4.1.25    [VIEW IN KEGG]
4.4.1.28    [VIEW IN KEGG]
4.4.1.35    [VIEW IN KEGG]
4.4.1.36    [VIEW IN KEGG]
4.5.1.2    [VIEW IN KEGG]
6.4.1.1    [VIEW IN KEGG]
7.2.4.2    [VIEW IN KEGG]
1.1.1.59    [VIEW IN KEGG]
1.1.1.298    [VIEW IN KEGG]
1.2.1.15    [VIEW IN KEGG]
1.2.1.18    [VIEW IN KEGG]
1.2.1.27    [VIEW IN KEGG]
1.2.1.75    [VIEW IN KEGG]
1.7.3.5    [VIEW IN KEGG]
2.6.1.19    [VIEW IN KEGG]
2.6.1.55    [VIEW IN KEGG]
2.6.1.120    [VIEW IN KEGG]
4.1.2.29    [VIEW IN KEGG]
4.2.1.27    [VIEW IN KEGG]
4.2.1.155    [VIEW IN KEGG]
Ingredient_name:   Soyasaponin A1 Alias:   soyasaponin a1
Ingredient_formula:   C59H96O29 Ingredient_Smile:   CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1O)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C)(C)CO)OC8C(C(C(C(O8)C(=O)O)O)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(C(O1)CO)O)O)O)C)C
Ingredient_weight:   1269.38 OB_score:   4.944119965
PubChem_id:  441950 EC:  
-
Ingredient_name:   Soyasaponin I Alias:   (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,; CCRIS 6617; (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-4-methylol-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-methylol-3-[(2S,3R,4R,5R,6S)-3,4,5-t; Oleanane, b-D-glucopyranosiduronic acid deriv.; b-D-Glucopyranosiduronic acid, (3b,4b,22b)-22,23-dihydroxyolean-12-en-3-yl O-6-deoxy-.alpha.-L-mannopyranosyl-(1.2)-O-.beta.-D-galactopyranosyl-(1.2)-; 55366-25-1; AIDS000571; soyasaponin i; AIDS-000571; beta-D-Glucopyranosiduronic acid, (3beta,4beta,22beta)-22,23-dihydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-beta-D-galactopyranosyl-(1-2)-; (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,4; Soyasaponin Bb; soyasaponin i ; CHEBI:62916; soyasaponin I(1-); C08983; Soybean saponin fraction B1; 51330-27-9; SCM 3B
Ingredient_formula:   C48H78O18 Ingredient_Smile:   CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O
Ingredient_weight:   943.12 OB_score:   2.055317878
PubChem_id:  122097 EC:  
2.4.1.273    [VIEW IN KEGG]
Ingredient_name:   vitamin e Alias:   vitamin-e; LS-187838; alpha-tocopherol; tocopherol; β-Tocopherol; α-tocopher
Ingredient_formula:   C29H50O2 Ingredient_Smile:   CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C
Ingredient_weight:   430.7 g/mol OB_score:   NA
PubChem_id:  14985 EC:  
2.1.1.95    [VIEW IN KEGG]
1.14.18.9    [VIEW IN KEGG]