CHEBI:75726 - luteolin 3'-O-glucuronide

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ChEBI Name luteolin 3'-O-glucuronide
ChEBI ID CHEBI:75726
ChEBI ASCII Name luteolin 3'-O-glucuronide
Definition A luteolin glucosiduronic acid consisting of luteolin having a β-D-glucosiduronic acid residue attached at the 3'-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C21H18O12
Net Charge 0
Average Mass 462.36040
Monoisotopic Mass 462.07983
InChI InChI=1S/C21H18O12/c22-8-4-10(24)15-11(25)6-12(31-14(15)5-8)7-1-2-9(23)13(3-7)32-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-24,26-28H,(H,29,30)/t16-,17-,18+,19-,21+/m0/s1
InChIKey JDOFZOKGCYYUER-ZFORQUDYSA-N
SMILES O[C@H]1[C@@H](O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O)Oc1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)cc2o1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing luteolin 3'-O-glucuronide (CHEBI:75726) has role metabolite (CHEBI:25212)
luteolin 3'-O-glucuronide (CHEBI:75726) is a luteolin O-glucuronoside (CHEBI:25091)
luteolin 3'-O-glucuronide (CHEBI:75726) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name
5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenyl β-D-glucopyranosiduronic acid
Synonyms Sources
Luteolin 3'-glucuronide LIPID MAPS
luteolin 3'-O-β-D-glucopyranosiduronic acid ChEBI
luteolin 3'-O-β-D-glucoronopyranoside ChEBI
Manual Xref Database
LMPK12110650 LIPID MAPS
View more database links
Registry Number Type Source
7060350 Reaxys Registry Number Reaxys
Last Modified
25 November 2013