CHEBI:31743 - kaempferol 3-O-β-D-glucosyl-(1→2)-β-D-glucoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name kaempferol 3-O-β-D-glucosyl-(1→2)-β-D-glucoside
ChEBI ID CHEBI:31743
ChEBI ASCII Name kaempferol 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside
Definition A sophoroside that is kaempferol attached to a β-D-sophorosyl residue at position 3 via a glycosidic linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H30O16
Net Charge 0
Average Mass 610.51750
Monoisotopic Mass 610.15338
InChI InChI=1S/C27H30O16/c28-7-14-17(33)20(36)22(38)26(40-14)43-25-21(37)18(34)15(8-29)41-27(25)42-24-19(35)16-12(32)5-11(31)6-13(16)39-23(24)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-22,25-34,36-38H,7-8H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1
InChIKey LKZDFKLGDGSGEO-UJECXLDQSA-N
SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](Oc3c(oc4cc(O)cc(O)c4c3=O)-c3ccc(O)cc3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing kaempferol 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:31743) has role plant metabolite (CHEBI:76924)
kaempferol 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:31743) is a sophoroside (CHEBI:145470)
kaempferol 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:31743) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name
5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
Synonyms Sources
3-((2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one ChemIDplus
Kaempferol 3-O-beta-D-sophoroside KEGG COMPOUND
kaempferol 3-O-sophoroside ChemIDplus
Kaempferol-3-O-beta-D-sophoroside KEGG COMPOUND
Sophoraflavonoloside KEGG COMPOUND
Manual Xrefs Databases
C00005165 KNApSAcK
C12634 KEGG COMPOUND
CPD-8067 MetaCyc
View more database links
Registry Numbers Types Sources
19895-95-5 CAS Registry Number KEGG COMPOUND
19895-95-5 CAS Registry Number ChemIDplus
75115 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
14577635 PubMed citation Europe PMC
17566335 PubMed citation Europe PMC
895396 PubMed citation Europe PMC
Last Modified
22 November 2019