CHEBI:32082 - quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside

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ChEBI Name quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside
ChEBI ID CHEBI:32082
ChEBI ASCII Name quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside
Definition A quercetin O-glucoside that is quercetin 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 ZINC000004654817
Download Molfile XML SDF
Formula C27H30O17
Net Charge 0
Average Mass 626.51690
Monoisotopic Mass 626.14830
InChI InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1
InChIKey RDUAJIJVNHKTQC-UJECXLDQSA-N
SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](Oc3c(oc4cc(O)cc(O)c4c3=O)-c3ccc(O)c(O)c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
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 quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) has role antioxidant (CHEBI:22586)
quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) has role plant metabolite (CHEBI:76924)
quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is a sophoroside (CHEBI:145470)
quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is a tetrahydroxyflavone (CHEBI:38684)
quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082) is conjugate acid of quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside(1−) (CHEBI:144438)
Incoming quercetin 3-O-[(6-O-caffeoyl-β-D-glucosyl)-(1→2)-β-D-glucoside] (CHEBI:145787) has functional parent quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082)
quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside(1−) (CHEBI:144438) is conjugate base of quercetin 3-O-β-D-glucosyl-(1→2)-β-D-glucoside (CHEBI:32082)
IUPAC Name
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
Synonyms Sources
2-(3,4-dihydroxyphenyl)-3-((2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy)-5,7-dihydroxy-4H-1-benzopyran-4-one ChemIDplus
Baimaside KEGG COMPOUND
Quercetin 3-beta-D-sophoroside KEGG COMPOUND
Quercetin 3-O-sophoroside KEGG COMPOUND
QUOSP KEGG COMPOUND
Manual Xrefs Databases
C00005409 KNApSAcK
C12667 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1278846 Reaxys Registry Number Reaxys
18609-17-1 CAS Registry Number KEGG COMPOUND
18609-17-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations
Last Modified
10 January 2020