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CHEBI:12256 - 7-hydroxyisoflavone

Default Structure
ChEBI IDCHEBI:12256
ChEBI Name7-hydroxyisoflavone
Stars
DefinitionThe simplest member of the class of 7-hydroxyisoflavones that is isoflavone with a hydroxy substituent at position 7.
Last Modified21 February 2017
DownloadsMolfile
FormulaC15H10O3
Net Charge0
Average Mass238.242
Monoisotopic Mass238.06299
SMILESO=c1c(-c2ccccc2)coc2cc(O)ccc12
InChIInChI=1S/C15H10O3/c16-11-6-7-12-14(8-11)18-9-13(15(12)17)10-4-2-1-3-5-10/h1-9,16H
InChIKeyWMKOZARWBMFKAS-UHFFFAOYSA-N
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.
EC 1.14.14.14 (aromatase) inhibitor  An EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor which interferes with the action of aromatase (EC 1.14.14.14) and so reduces production of estrogenic steroid hormones.
ChEBI Ontology
Outgoing Relation(s)
7-hydroxyisoflavone (CHEBI:12256) has role EC 1.14.14.14 (aromatase) inhibitor (CHEBI:50790)
7-hydroxyisoflavone (CHEBI:12256) has role metabolite (CHEBI:25212)
7-hydroxyisoflavone (CHEBI:12256) is a 7-hydroxyisoflavones (CHEBI:55465)
7-hydroxyisoflavone (CHEBI:12256) is conjugate acid of 7-hydroxyisoflavone(1−) (CHEBI:77616)
Incoming Relation(s)
7-hydroxyisoflavone 7-O-β-D-glucoside (CHEBI:18174) has functional parent 7-hydroxyisoflavone (CHEBI:12256)
glycitein (CHEBI:34778) is a 7-hydroxyisoflavone (CHEBI:12256)
glycitein 4'-O-glucuronide (CHEBI:133667) is a 7-hydroxyisoflavone (CHEBI:12256)
7-hydroxyisoflavone(1−) (CHEBI:77616) is conjugate base of 7-hydroxyisoflavone (CHEBI:12256)
IUPAC Name 
7-hydroxy-3-phenyl-4H-chromen-4-one
Synonym  Source
4H-1-Benzopyran-4-one, 7-hydroxy-3-phenyl-ChemIDplus
Manual XrefsDatabases
C15615KEGG COMPOUND
EP0941992Patent
Registry NumbersSources
Reaxys:193534Reaxys
CAS:13057-72-2ChemIDplus
Citations