CHEBI:79520 - 2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
ChEBI ID CHEBI:79520
ChEBI ASCII Name 2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
Definition A methoxyflavanone that is flavanone substituted by methoxy groups at positions 5, 7 and 4' and a hydroxy group at position 6.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H18O6
Net Charge 0
Average Mass 330.33190
Monoisotopic Mass 330.11034
InChI InChI=1S/C18H18O6/c1-21-11-6-4-10(5-7-11)13-8-12(19)16-14(24-13)9-15(22-2)17(20)18(16)23-3/h4-7,9,13,20H,8H2,1-3H3
InChIKey JEEVVZXYEKPPCC-UHFFFAOYSA-N
SMILES COc1ccc(cc1)C1CC(=O)c2c(O1)cc(OC)c(O)c2OC
ChEBI Ontology
Outgoing 2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79520) has functional parent flavanone (CHEBI:5070)
2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79520) is a 4'-methoxyflavanones (CHEBI:140332)
2,3-dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one (CHEBI:79520) is a monohydroxyflavanone (CHEBI:38748)
IUPAC Name
6-hydroxy-5,7-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one
Synonym Source
6-Hydroxy-4',5,7-trimethoxyflavanone KEGG COMPOUND
Manual Xref Database
C14997 KEGG COMPOUND
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Registry Numbers Types Sources
1267554 Reaxys Registry Number Reaxys
6626-61-5 CAS Registry Number ChemIDplus
Last Modified
06 April 2018