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CHEBI:7854 - oxyayanin A

ChEBI IDCHEBI:7854
ChEBI Nameoxyayanin A
Stars
DefinitionA trihydroxyflavone that is flavone substituted by hydroxy groups at positioms 5, 2' and 5' and methoxy groups at positions 3, 7 and 4' respectively.
Last Modified5 June 2015
DownloadsMolfile
FormulaC18H16O8
Net Charge0
Average Mass360.318
Monoisotopic Mass360.08452
SMILESCOc1cc(O)c2c(=O)c(OC)c(-c3cc(O)c(OC)cc3O)oc2c1
InChIInChI=1S/C18H16O8/c1-23-8-4-12(21)15-14(5-8)26-17(18(25-3)16(15)22)9-6-11(20)13(24-2)7-10(9)19/h4-7,19-21H,1-3H3
InChIKeyKGJTXYKKHKRNIM-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)
oxyayanin A (CHEBI:7854) has functional parent flavone (CHEBI:42491)
oxyayanin A (CHEBI:7854) has role plant metabolite (CHEBI:76924)
oxyayanin A (CHEBI:7854) is a trihydroxyflavone (CHEBI:27116)
oxyayanin A (CHEBI:7854) is a trimethoxyflavone (CHEBI:27124)
IUPAC Name 
2-(2,5-dihydroxy-4-methoxyphenyl)-5-hydroxy-3,7-dimethoxy-4H-1-benzopyran-4-one
Synonym  Source
5,2',5'-trihydroxy-3,7,4'-trimethoxyflavoneChEBI
Manual XrefsDatabases
C10115KEGG COMPOUND
C00001079KNApSAcK
LMPK12112516LIPID MAPS
Registry NumbersSources
CAS:549-17-7KEGG COMPOUND
Citations