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CHEBI:79477 - 2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one

ChEBI IDCHEBI:79477
ChEBI Name2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
Stars
ASCII Name2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
DefinitionA methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3', 4' and 5'.
Last Modified14 October 2014
DownloadsMolfile
FormulaC22H24O9
Net Charge0
Average Mass432.425
Monoisotopic Mass432.14203
SMILESCOc1cc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc(OC)c1OC
InChIInChI=1S/C22H24O9/c1-24-14-8-11(9-15(25-2)17(14)26-3)13-10-12(23)16-18(27-4)20(28-5)22(30-7)21(29-6)19(16)31-13/h8-10H,1-7H3
InChIKeyUAELIRBOLQZEAT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ageratum corymbosum (IPNI:175482-1) - DOI (10.1016/S0031-9422(00)91044-6)
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-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:79477) has functional parent flavone (CHEBI:42491)
2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:79477) has role plant metabolite (CHEBI:76924)
2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:79477) is a methoxyflavone (CHEBI:25241)
IUPAC Name 
5,6,7,8-tetramethoxy-2-(3,4,5-trimethoxyphenyl)-4H-chromen-4-one
Synonym  Source
5,6,7,8,3',4',5'-heptamethoxyflavoneChEBI
Manual XrefsDatabases
C14953KEGG COMPOUND
C00003977KNApSAcK
LMPK12111494LIPID MAPS
Registry NumbersSources
Reaxys:368154Reaxys
CAS:6965-36-2KEGG COMPOUND
CAS:6965-36-2ChemIDplus