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CHEBI:67377 - 6,8-dimethylisogenistein

ChEBI IDCHEBI:67377
ChEBI Name6,8-dimethylisogenistein
Stars
DefinitionA member of the class of 7-hydroxyisoflavones that is isoflavone substituted by hydroxy groups at positions 5, 7 and 2' and methyl group at positions 6 and 8. It has been isolated from Pisonia aculeata.
Last Modified20 November 2013
DownloadsMolfile
FormulaC17H14O5
Net Charge0
Average Mass298.294
Monoisotopic Mass298.08412
SMILESCc1c(O)c(C)c2occ(-c3ccccc3O)c(=O)c2c1O
InChIInChI=1S/C17H14O5/c1-8-14(19)9(2)17-13(15(8)20)16(21)11(7-22-17)10-5-3-4-6-12(10)18/h3-7,18-20H,1-2H3
InChIKeyVYFQDBFEAYEXCL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pisonia aculeata (ncbitaxon:363212)
root (BTO:0001188) PubMed (21542597) Cold methanolic extract of dried stems and roots
stem (BTO:0001300) PubMed (21542597) Cold methanolic extract of dried stems and roots
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
6,8-dimethylisogenistein (CHEBI:67377) has role metabolite (CHEBI:25212)
6,8-dimethylisogenistein (CHEBI:67377) has role plant metabolite (CHEBI:76924)
6,8-dimethylisogenistein (CHEBI:67377) is a 2'-hydroxyisoflavones (CHEBI:28206)
6,8-dimethylisogenistein (CHEBI:67377) is a 7-hydroxyisoflavones (CHEBI:55465)
IUPAC Name 
5,7-dihydroxy-3-(2-hydroxyphenyl)-6,8-dimethyl-4H-chromen-4-one
Synonym  Source
5,7,2'-trihydroxy-6,8-dimethylisoflavoneChEBI
Registry NumbersSources
Reaxys:22255185Reaxys
Citations