EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:79467 - 2-(2,5-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one

ChEBI IDCHEBI:79467
ChEBI Name2-(2,5-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
Stars
ASCII Name2-(2,5-dimethoxyphenyl)-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, 2' and 5'.
Last Modified14 October 2014
DownloadsMolfile
FormulaC21H22O8
Net Charge0
Average Mass402.399
Monoisotopic Mass402.13147
SMILESCOc1ccc(OC)c(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)c1
InChIInChI=1S/C21H22O8/c1-23-11-7-8-14(24-2)12(9-11)15-10-13(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-15/h7-10H,1-6H3
InChIKeyFJNLODZIVSPGBA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(2,5-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:79467) has functional parent flavone (CHEBI:42491)
2-(2,5-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one (CHEBI:79467) is a methoxyflavone (CHEBI:25241)
IUPAC Name 
2-(2,5-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-chromen-4-one
Synonym  Source
2',5',5,6,7,8-hexamethoxyflavoneChEBI
Manual XrefsDatabases
C14943KEGG COMPOUND
Registry NumbersSources
Reaxys:8086965Reaxys
CAS:70460-30-9KEGG COMPOUND
CAS:70460-30-9ChemIDplus