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apigenin 7-O-beta-D-glucoside

PropertiesImage
MNX_IDMNXM2794 Image of MNXM2794
referencechebi:77722
formulaC21H19O10
global charge-1
mol weight431.373
InChIKeyKMOUJOKENFFTPU-QNDFHXLGSA-M
InChIInChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/p-1/t16-,18-,19+,20-,21-/m1/s1
SMILESO=C1C=C(C2=CC=C(O)C=C2)OC2=C1C([O-])=CC(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C2
MNX internals
InChI (mnx)InChI=1/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1 Image of MNXM2794
SMILES (mnx)[CH:1]1=[CH:3][C:10]([OH:23])=[CH:4][CH:2]=[C:9]1[C:14]1=[CH:7][C:13](=[O:25])[C:17]2=[C:12]([OH:24])[CH:5]=[C:11]([O:29][C@H:21]3[C@H:20]([OH:28])[C@@H:19]([OH:27])[C@H:18]([OH:26])[C@@H:16]([CH2:8][OH:22])[O:31]3)[CH:6]=[C:15]2[O:30]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77722
chebi:77722
KMOUJOKENFFTPU-QNDFHXLGSA-M 		apigenin 7-O-beta-D-glucoside
7-(beta-D-glucopyranosyloxy)-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-olate
apigenin 7-O-beta-D-glucoside(1-)

sabiork.compound:7432
sabiorkM:7432
KMOUJOKENFFTPU-QNDFHXLGSA-N 		7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1- benzopyran-4-one
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Apigenin 7-O-beta-D-glucoside
Apigenin 7-O-glucoside
Apigetrin
Cosmetin
Cosmosiin

vmhM:a7obglsd
vmhmetabolite:a7obglsd
KMOUJOKENFFTPU-QNDFHXLGSA-N 		Apigenin 7-O-beta-D-glucoside
5-hydroxy-2-(4-hydroxyphenyl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

kegg.compound:C04608
keggC:C04608
KMOUJOKENFFTPU-QNDFHXLGSA-N 		Apigenin 7-O-beta-D-glucoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
Apigenin 7-O-glucoside
Apigetrin
Cosmetin
Cosmosiin

lipidmaps:LMPK12110336
lipidmapsM:LMPK12110336
KMOUJOKENFFTPU-QNDFHXLGSA-N 		Apigenin 7-O-glucoside
4',5,7-Trihydroxyflavone 7-glucoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Apigetrin
Cosmetin
Cosmosiin
Cosmosioside

seed.compound:cpd02807
seedM:cpd02807
KMOUJOKENFFTPU-QNDFHXLGSA-M 		Cosmetin
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1- benzopyran-4-one
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-glucosyl-apigenin
Apigenin 7-O-beta-D-glucoside
Apigenin 7-O-glucoside
Apigetrin
Cosmosiin
apigenin 7-O-beta-D-glucoside
cosmosiin
cosmosin
hmdb:HMDB0037340
KMOUJOKENFFTPU-QNDFHXLGSA-N 		Cosmosiin
4',5,7-Trihydroxyflavone 7-beta-D-glucoside
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl b-D-glucopyranoside
5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside
5-hydroxy-2-(4-hydroxyphenyl)-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
7-(b-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-O-b-D-Glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-Glucopyranosylapigenin
7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-Glucosylapigenin
7-O-beta-D-glucopyranosylapigenin
7-O-beta-D-glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-glucosylapigenin
Apigenin 7-O-b-D-glucoside
Apigenin 7-O-beta-D-glucopyranoside
Apigenin 7-O-beta-D-glucoside
Apigenin 7-O-beta-glucopyranoside
Apigenin 7-O-beta-glucoside
Apigenin 7-O-glucoside
Apigenin 7-beta-D-glucoside
Apigenin 7-beta-glucopyranoside
Apigenin 7-glucoside
Apigenin-7-D-glucoside
Apigenin-7-O-4C1-beta-D-glucoside
Apigenin-7-O-beta-D-glucopyranoside
Apigenin-7-glucoside
Apigetrin
Cosmetin
Cosmociin
Cosmoside
Cosmosiine
Cosmosioside
apigenin 7-o-beta-glucoside

CHEBI:16778
chebi:16778
KMOUJOKENFFTPU-QNDFHXLGSA-N 		apigenin 7-O-beta-D-glucoside
5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside
7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
Apigenin 7-O-glucoside
Apigetrin
Cosmetin
Cosmosiin
Cosmosioside

metacyc.compound:APIGENIN-7-O-BETA-D-GLUCOSIDE
metacycM:APIGENIN-7-O-BETA-D-GLUCOSIDE
KMOUJOKENFFTPU-QNDFHXLGSA-M 		apigenin 7-O-beta-D-glucoside
7-(beta-D-glucopyranosyloxy)-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-olate
7-O-beta-D-glucosyl-5,7,4'-trihydroxyflavone
7-O-beta-D-glucosyl-apigenin
apigenin 7-O-beta-D-glucoside(1-)
cosmosiin
cosmosin

hmdb:HMDB37340
chebi:12252
chebi:20780
chebi:2282
keggC:M_C04608
seedM:M_cpd02807
vmhM:M_a7obglsd 		secondary/obsolete/fantasy identifier