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genistein 7-O-beta-D-glucoside

PropertiesImage
MNX_IDMNXM1371298 Image of MNXM1371298
referencechebi:140305
formulaC21H19O10
global charge-1
mol weight431.373
InChIKeyZCOLJUOHXJRHDI-CMWLGVBASA-M
InChIInChI=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/p-1/t15-,18-,19+,20-,21-/m1/s1
SMILESO=C1C(C2=CC=C(O)C=C2)=COC2=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=CC([O-])=C12
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM1371298
SMILES (mnx)[CH:1]1=[CH:3][C:10]([OH:23])=[CH:4][CH:2]=[C:9]1[C:12]1=[CH:8][O:29][C:14]2=[CH:6][C:11]([O:30][C@H:21]3[C@H:20]([OH:28])[C@@H:19]([OH:27])[C@H:18]([OH:26])[C@@H:15]([CH2:7][OH:22])[O:31]3)=[CH:5][C:13]([OH:24])=[C:16]2[C:17]1=[O:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:140305
chebi:140305
ZCOLJUOHXJRHDI-CMWLGVBASA-M 		genistein 7-O-beta-D-glucoside
7-(beta-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-5-olate
genistein 7-O-beta-D-glucoside(1-)
genistein 7-beta-D-glucoside(1-)
genistein 7-beta-glucoside(1-)
genistin(1-)

sabiork.compound:11217
sabiorkM:11217
ZCOLJUOHXJRHDI-CMWLGVBASA-N 		Genistein 7-O-beta-D-glucoside
Genistin

lipidmaps:LMPK12050166
lipidmapsM:LMPK12050166
ZCOLJUOHXJRHDI-CMWLGVBASA-N 		Genistein 7-O-glucoside
4',5,7-Trihydroxyisoflavone 7-glucoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Genistin

seed.compound:cpd06022
seedM:cpd06022
kegg.compound:C09126
keggC:C09126
ZCOLJUOHXJRHDI-CMWLGVBASA-N 		Genistin
Genistein 7-O-beta-D-glucoside

CHEBI:27514
chebi:27514
ZCOLJUOHXJRHDI-CMWLGVBASA-N 		genistein 7-O-beta-D-glucoside
4',5,7-trihydroxyisoflavone 7-D-glucoside
5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside
Genistein 7-O-beta-D-glucoside
Genistein 7-glucoside
Genisteol 7-monoglucoside
Genistin
Genistine
Genistoside

metacyc.compound:CPD-3421
metacycM:CPD-3421
seed.compound:cpd24409
seedM:cpd24409
ZCOLJUOHXJRHDI-CMWLGVBASA-M
ZCOLJUOHXJRHDI-CMWLGVBASA-N 		genistin
genistein 7-O-glucoside

chebi:24205
chebi:5303
keggC:M_C09126
seedM:M_cpd06022
seedM:M_cpd24409 		secondary/obsolete/fantasy identifier