CHEBI:32081 - quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside]

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ChEBI Name quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside]
ChEBI ID CHEBI:32081
ChEBI ASCII Name quercetin 3-O-[beta-D-xylosyl-(1->2)-beta-D-glucoside]
Definition A quercetin O-glucoside that is quercetin attached to a β-D-sambubiosyl residue at position 3 via a glycosidc linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H28O16
Net Charge 0
Average Mass 596.49090
Monoisotopic Mass 596.13773
InChI InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15-,17+,18-,20+,21-,24-,25+,26+/m1/s1
InChIKey NKFZLEYLWAFYEH-CJNLAGEVSA-N
SMILES OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[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-xylosyl-(1→2)-β-D-glucoside] (CHEBI:32081) has role antioxidant (CHEBI:22586)
quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside] (CHEBI:32081) has role plant metabolite (CHEBI:76924)
quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside] (CHEBI:32081) is a disaccharide derivative (CHEBI:63353)
quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside] (CHEBI:32081) is a quercetin O-glucoside (CHEBI:64621)
quercetin 3-O-[β-D-xylosyl-(1→2)-β-D-glucoside] (CHEBI:32081) is a tetrahydroxyflavone (CHEBI:38684)
IUPAC Name
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2-O-β-D-xylopyranosyl-β-D-glucopyranoside
Synonyms Sources
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy)-4H-1-benzopyran-4-one ChemIDplus
quercetin 3-sambubioside ChemIDplus
Manual Xrefs Databases
C12637 KEGG COMPOUND
LMPK12112090 LIPID MAPS
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Registry Numbers Types Sources
4344863 Reaxys Registry Number Reaxys
83048-35-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
10230515 PubMed citation Europe PMC
15598565 PubMed citation Europe PMC
Last Modified
09 January 2014