2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542)

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ChEBI Name	2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one

ChEBI ID	CHEBI:79542

ChEBI ASCII Name	2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one

Definition	A methoxyflavanone that is flavanone substituted by methoxy groups at positions 5, 6 and 7 and a hydroxy group at position 4'.

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

Supplier Information

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Formula

C18H18O6

Net Charge

Average Mass

330.33190

Monoisotopic Mass

330.11034

InChI

InChI=1S/C18H18O6/c1-21-15-9-14-16(18(23-3)17(15)22-2)12(20)8-13(24-14)10-4-6-11(19)7-5-10/h4-7,9,13,19H,8H2,1-3H3

InChIKey

PDGDCUUTDPJPTI-UHFFFAOYSA-N

SMILES

COc1cc2OC(CC(=O)c2c(OC)c1OC)c1ccc(O)cc1

Metabolite of Species	Details
Chromolaena odorata (NCBI:txid103745)	See: DOI

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542) has functional parent flavanone (CHEBI:5070) 2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542) has role plant metabolite (CHEBI:76924) 2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542) is a 4'-hydroxyflavanones (CHEBI:140331) 2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542) is a methoxyflavanone (CHEBI:25240) 2,3-dihydro-2-(4-hydroxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79542) is a monohydroxyflavanone (CHEBI:38748)

IUPAC Name

2-(4-hydroxyphenyl)-5,6,7-trimethoxy-2,3-dihydro-4H-chromen-4-one

Synonym	Source
4'-Hydroxy-5,6,7-trimethoxyflavanone	KEGG COMPOUND

Registry Number	Type	Source
1264950	Reaxys Registry Number	Reaxys

Last Modified

05 April 2018