luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] (CHEBI:60077)

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CHEBI:60077 - luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide]

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ChEBI ID	CHEBI:60077
ChEBI Name	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide]
Stars
ASCII Name	luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]
Definition	The glycosyloxyflavone resulting from the condensation of the hydroxy group at position 7 of luteolin with the 1 position of 2-O-β-D-glucopyranuronosyl-β-D-glucopyranosiduronic acid.
Last Modified	28 July 2014
Submitter	Gareth Owen
Downloads	Molfile

Formula	C27H26O18
Net Charge	0
Average Mass	638.487
Monoisotopic Mass	638.11191
SMILES	O=C(O)[C@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChI	InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1
InChIKey	PBBVWJQPAZYQDB-DBFWEQBMSA-N

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is a dicarboxylic acid (CHEBI:35692)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is a disaccharide derivative (CHEBI:63353)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is a glycosyloxyflavone (CHEBI:50018)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is a luteolin O-glucuronoside (CHEBI:25091)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is a trihydroxyflavone (CHEBI:27116)
	luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077) is conjugate acid of luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)] (CHEBI:57815)
Incoming Relation(s)
Incoming Relation(s)	luteolin 7-O-[(β-D-glucosiduronate)-(1→2)-(β-D-glucosiduronate)] (CHEBI:57815) is conjugate base of luteolin-7-O-[β-D-glucuronosyl-(1→2)-β-D-glucuronide] (CHEBI:60077)

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

Synonyms	Source
luteolin-7-O-[β-glucuronosyl-(1→2)-β-glucuronide]	ChEBI
Luteolin 7-O-beta-D-diglucuronide	KEGG COMPOUND

Manual Xrefs	Databases
C12632	KEGG COMPOUND

Registry Numbers	Sources
Reaxys:6362694	Reaxys