CHEBI:84039 - dihydroresveratrol-3-O-β-D-glucuronide

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ChEBI Name dihydroresveratrol-3-O-β-D-glucuronide
ChEBI ID CHEBI:84039
ChEBI ASCII Name dihydroresveratrol-3-O-beta-D-glucuronide
Definition A monosaccharide derivative that is the 7-O-glucuronide of dihydroresveratrol .
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H22O9
Net Charge 0
Average Mass 406.38330
Monoisotopic Mass 406.12638
InChI InChI=1S/C20H22O9/c21-12-5-3-10(4-6-12)1-2-11-7-13(22)9-14(8-11)28-20-17(25)15(23)16(24)18(29-20)19(26)27/h3-9,15-18,20-25H,1-2H2,(H,26,27)/t15-,16-,17+,18-,20+/m0/s1
InChIKey NXXGJRZWYCYPCB-HBWRTXEVSA-N
SMILES O[C@@H]1[C@@H](O)[C@H](Oc2cc(O)cc(CCc3ccc(O)cc3)c2)O[C@@H]([C@H]1O)C(O)=O
Roles Classification
Biological Role(s): xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound.
(via dihydroresveratrol glucuronide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dihydroresveratrol-3-O-β-D-glucuronide (CHEBI:84039) is a dihydroresveratrol glucuronide (CHEBI:84047)
dihydroresveratrol-3-O-β-D-glucuronide (CHEBI:84039) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
3-hydroxy-5-[2-(4-hydroxyphenyl)ethyl]phenyl β-D-glucopyranosiduronic acid
Citations Waiting for Citations Types Sources
20509689 PubMed citation Europe PMC
23727867 PubMed citation Europe PMC
Last Modified
09 December 2014