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CHEBI:7855 - oxyayanin B

ChEBI IDCHEBI:7855
ChEBI Nameoxyayanin B
Stars
DefinitionA trihydroxyflavone that is flavone substituted by hydroxy groups at positioms 5, 6 and 3' and methoxy groups at positions 3, 7 and 4' respectively.
Last Modified5 June 2015
DownloadsMolfile
FormulaC18H16O8
Net Charge0
Average Mass360.318
Monoisotopic Mass360.08452
SMILESCOc1ccc(-c2oc3cc(OC)c(O)c(O)c3c(=O)c2OC)cc1O
InChIInChI=1S/C18H16O8/c1-23-10-5-4-8(6-9(10)19)17-18(25-3)16(22)13-11(26-17)7-12(24-2)14(20)15(13)21/h4-7,19-21H,1-3H3
InChIKeyUQBUUCDVKDSHCE-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 B (CHEBI:7855) has functional parent flavone (CHEBI:42491)
oxyayanin B (CHEBI:7855) has role plant metabolite (CHEBI:76924)
oxyayanin B (CHEBI:7855) is a trihydroxyflavone (CHEBI:27116)
oxyayanin B (CHEBI:7855) is a trimethoxyflavone (CHEBI:27124)
IUPAC Name 
5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-dimethoxy-4H-1-benzopyran-4-one
Synonym  Source
3',5,6-trihydroxy-3,4',7-trimethoxyflavoneChEBI
Manual XrefsDatabases
C10116KEGG COMPOUND
C00004696KNApSAcK
Registry NumbersSources
Reaxys:352506Reaxys
CAS:548-74-3KEGG COMPOUND