5-Hydroxy-3,8-dimethoxy-3',4'-methylenedioxy-7-prenyloxyflavone (CHEBI:186727)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	5-Hydroxy-3,8-dimethoxy-3',4'-methylenedioxy-7-prenyloxyflavone

ChEBI ID	CHEBI:186727

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C23H22O8

Net Charge

Average Mass

426.421

Monoisotopic Mass

426.13147

InChI

InChI=1S/C23H22O8/c1-12(2)7-8-28-17-10-14(24)18-19(25)23(27-4)20(31-22(18)21(17)26-3)13-5-6-15-16(9-13)30-11-29-15/h5-7,9-10,24H,8,11H2,1-4H3

InChIKey

IBKHFDNXHBVBAD-UHFFFAOYSA-N

SMILES

O1C2=C(C(=O)C(OC)=C1C3=CC=4OCOC4C=C3)C(O)=CC(OCC=C(C)C)=C2OC

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	5-Hydroxy-3,8-dimethoxy-3',4'-methylenedioxy-7-prenyloxyflavone (CHEBI:186727) is a ether (CHEBI:25698) 5-Hydroxy-3,8-dimethoxy-3',4'-methylenedioxy-7-prenyloxyflavone (CHEBI:186727) is a flavonoids (CHEBI:72544)

IUPAC Name

2-(1,3-benzodioxol-5-yl)-5-hydroxy-3,8-dimethoxy-7-(3-methylbut-2-enoxy)chromen-4-one