EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:2769 - apigenin 7,4'-dimethyl ether

ChEBI IDCHEBI:2769
ChEBI Nameapigenin 7,4'-dimethyl ether
Stars
DefinitionA dimethoxyflavone that is the 7,4'-dimethyl ether derivative of apigenin.
Last Modified19 August 2022
DownloadsMolfile
FormulaC17H14O5
Net Charge0
Average Mass298.294
Monoisotopic Mass298.08412
SMILESCOc1ccc(-c2cc(=O)c3c(O)cc(OC)cc3o2)cc1
InChIInChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)15-9-14(19)17-13(18)7-12(21-2)8-16(17)22-15/h3-9,18H,1-2H3
InChIKeyLZERJKGWTQYMBB-UHFFFAOYSA-N
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)
apigenin 7,4'-dimethyl ether (CHEBI:2769) has functional parent apigenin (CHEBI:18388)
apigenin 7,4'-dimethyl ether (CHEBI:2769) has role plant metabolite (CHEBI:76924)
apigenin 7,4'-dimethyl ether (CHEBI:2769) is a dimethoxyflavone (CHEBI:23798)
apigenin 7,4'-dimethyl ether (CHEBI:2769) is a monohydroxyflavone (CHEBI:38687)
IUPAC Name 
5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
Synonyms  Source
Apigenin dimethyletherKEGG COMPOUND
4,7-dimethoxy-5-hydroxyflavoneChemIDplus
genkwanin 4'-methyl etherChemIDplus
4',7-dimethylapigeninChemIDplus
UniProt Name  Source
apigenin 4',7-dimethyl etherUniProt
Manual XrefsDatabases
C10019KEGG COMPOUND
C00001016KNApSAcK
LMPK12111029LIPID MAPS
Registry NumbersSources
Reaxys:295742Reaxys
CAS:5128-44-9KEGG COMPOUND
CAS:5128-44-9ChemIDplus
Citations