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CHEBI:75802 - kaempferol 5-O-β-D-glucopyranoside

ChEBI IDCHEBI:75802
ChEBI Namekaempferol 5-O-β-D-glucopyranoside
Stars
ASCII Namekaempferol 5-O-beta-D-glucopyranoside
DefinitionA kaempferol O-glucoside that is kaempferol attached to a β-D-glucopyranosyl moiety at position 5 via a glycosidic linkage.
Last Modified9 January 2014
Submittermwilliams
DownloadsMolfile
FormulaC21H20O11
Net Charge0
Average Mass448.380
Monoisotopic Mass448.10056
SMILESO=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12
InChIInChI=1S/C21H20O11/c22-7-13-15(25)17(27)19(29)21(32-13)31-12-6-10(24)5-11-14(12)16(26)18(28)20(30-11)8-1-3-9(23)4-2-8/h1-6,13,15,17,19,21-25,27-29H,7H2/t13-,15-,17+,19-,21-/m1/s1
InChIKeyZSDLSQASILNAAH-HMGRVEAOSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) has functional parent β-D-glucose (CHEBI:15903)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) has role plant metabolite (CHEBI:76924)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) is a flavonols (CHEBI:28802)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) is a kaempferol O-glucoside (CHEBI:64634)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) is a monosaccharide derivative (CHEBI:63367)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) is a trihydroxyflavone (CHEBI:27116)
kaempferol 5-O-β-D-glucopyranoside (CHEBI:75802) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
3,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl β-D-glucopyranoside
Registry NumbersSources
Reaxys:11227163Reaxys
Citations