luteolin 7-O-beta-D-glucosiduronic acid (CHEBI:18128)

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CHEBI:18128 - luteolin 7-O-β-D-glucosiduronic acid

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ChEBI ID	CHEBI:18128
ChEBI Name	luteolin 7-O-β-D-glucosiduronic acid
Stars
ASCII Name	luteolin 7-O-beta-D-glucosiduronic acid
Definition	A luteolin glucosiduronic acid consisting of luteolin having a β-D-glucosiduronic acid residue attached at the 7-position.
Secondary ChEBI IDs	CHEBI:6583, CHEBI:14538, CHEBI:14540, CHEBI:25090
Last Modified	17 April 2014
Downloads	Molfile

Formula	C21H18O12
Net Charge	0
Average Mass	462.363
Monoisotopic Mass	462.07983
SMILES	O=C(O)[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O
InChI	InChI=1S/C21H18O12/c22-9-2-1-7(3-10(9)23)13-6-12(25)15-11(24)4-8(5-14(15)32-13)31-21-18(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	VSUOKLTVXQRUSG-ZFORQUDYSA-N

Roles Classification

Biological Role:

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology

Outgoing Relation(s)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) has role metabolite (CHEBI:25212)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is a glycosyloxyflavone (CHEBI:50018)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is a luteolin O-glucuronoside (CHEBI:25091)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is a monosaccharide derivative (CHEBI:63367)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is a trihydroxyflavone (CHEBI:27116)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is conjugate acid of luteolin 7-O-β-D-glucosiduronate (CHEBI:58385)
	luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128) is conjugate acid of luteolin 7-O-β-D-glucosiduronate(2−) (CHEBI:77671)
Incoming Relation(s)
	luteolin 7-O-β-D-glucosiduronate (CHEBI:58385) is conjugate base of luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128)
	luteolin 7-O-β-D-glucosiduronate(2−) (CHEBI:77671) is conjugate base of luteolin 7-O-β-D-glucosiduronic acid (CHEBI:18128)

IUPAC Name
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl β-D-glucopyranosiduronic acid

Synonyms	Source
Cyanidenon-7-O-beta-D-glucuronic acid	ChemIDplus
Luteolin 7-glucuronide	ChemIDplus
Luteolin 7-O-beta-D-glucuronopyranoside	ChemIDplus
Luteolin 7-O-glucuronide	KEGG COMPOUND

Manual Xrefs	Databases
C03515	KEGG COMPOUND
LMPK12110644	LIPID MAPS
LUTEOLIN-7-O-BETA-D-GLUCURONIDE	MetaCyc

Registry Numbers	Sources
Reaxys:5785426	Reaxys
CAS:29741-10-4	ChemIDplus

Citations