quercetin 3,4'-dimethyl ether (CHEBI:70008)

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ChEBI Name	quercetin 3,4'-dimethyl ether

ChEBI ID	CHEBI:70008

Definition	A dimethoxyflavone that is the 3,4'-dimethyl ether derivative of quercetin. Isolated from Combretum quadrangulare, it exhibits antineoplastic activity.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C17H14O7

Net Charge

Average Mass

330.28890

Monoisotopic Mass

330.07395

InChI

InChI=1S/C17H14O7/c1-22-12-4-3-8(5-10(12)19)16-17(23-2)15(21)14-11(20)6-9(18)7-13(14)24-16/h3-7,18-20H,1-2H3

InChIKey

ZSPZNFOLWQEVQJ-UHFFFAOYSA-N

SMILES

COc1ccc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1OC

Metabolite of Species	Details
Combretum quadrangulare (IPNI:170410-1)	Found in leaf (BTO:0000713). Methanolic extract of leaves See: PubMed

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.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	quercetin 3,4'-dimethyl ether (CHEBI:70008) has functional parent quercetin (CHEBI:16243) quercetin 3,4'-dimethyl ether (CHEBI:70008) has role antineoplastic agent (CHEBI:35610) quercetin 3,4'-dimethyl ether (CHEBI:70008) has role metabolite (CHEBI:25212) quercetin 3,4'-dimethyl ether (CHEBI:70008) is a dimethoxyflavone (CHEBI:23798) quercetin 3,4'-dimethyl ether (CHEBI:70008) is a trihydroxyflavone (CHEBI:27116)

IUPAC Name

5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-4H-chromen-4-one

Synonym	Source
5,7,3'-trihydroxy-3,4'-dimethoxyflavone	ChEBI

Registry Number	Type	Source
331172	Reaxys Registry Number	Reaxys

Citation	Type	Source
21265555	PubMed citation	Europe PMC

Last Modified

29 April 2013