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CHEBI:79637 - 2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one

ChEBI IDCHEBI:79637
ChEBI Name2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one
Stars
ASCII Name2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one
DefinitionA methoxyflavanone that is flavanone substituted by methoxy groups at positions 5, 6, 7 and 4'.
Last Modified6 April 2018
DownloadsMolfile
FormulaC19H20O6
Net Charge0
Average Mass344.363
Monoisotopic Mass344.12599
SMILESCOc1ccc(C2CC(=O)c3c(cc(OC)c(OC)c3OC)O2)cc1
InChIInChI=1S/C19H20O6/c1-21-12-7-5-11(6-8-12)14-9-13(20)17-15(25-14)10-16(22-2)18(23-3)19(17)24-4/h5-8,10,14H,9H2,1-4H3
InChIKeyAENXIAWIJGWYCP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Polygonum aviculare (ncbitaxon:137693) - Article (The genus polygonum (polygonaceae): an ethnopharmacological and phytochemical perspectives-Review)
Roles Classification
Biological Role:
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 Relation(s)
2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79637) has functional parent flavanone (CHEBI:5070)
2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79637) has role plant metabolite (CHEBI:76924)
2,3-dihydro-2-(4-methoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one (CHEBI:79637) is a 4'-methoxyflavanones (CHEBI:140332)
IUPAC Name 
5,6,7-trimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one
Synonym  Source
4',5,6,7-TetramethoxyflavanoneKEGG COMPOUND
Manual XrefsDatabases
C00008234KNApSAcK
C15118KEGG COMPOUND
LMPK12140620LIPID MAPS
Registry NumbersSources
CAS:2569-77-9KEGG COMPOUND