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CHEBI:18220 - isoflavone

Default Structure
ChEBI IDCHEBI:18220
ChEBI Nameisoflavone
Stars
DefinitionA simplest member of the class of isoflavones that is 4H-chromen-4-one in which the hydrogen at position 3 is replaced by a phenyl group.
Secondary ChEBI IDsCHEBI:6013, CHEBI:14467, CHEBI:24892
Last Modified13 September 2019
DownloadsMolfile
FormulaC15H10O2
Net Charge0
Average Mass222.243
Monoisotopic Mass222.06808
SMILESO=c1c(-c2ccccc2)coc2ccccc12
InChIInChI=1S/C15H10O2/c16-15-12-8-4-5-9-14(12)17-10-13(15)11-6-2-1-3-7-11/h1-10H
InChIKeyGOMNOOKGLZYEJT-UHFFFAOYSA-N
Roles Classification
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
renoprotective agent  Any compound that is able to prevent damage to the kidneys.
ChEBI Ontology
Outgoing Relation(s)
isoflavone (CHEBI:18220) has role antineoplastic agent (CHEBI:35610)
isoflavone (CHEBI:18220) has role renoprotective agent (CHEBI:231911)
isoflavone (CHEBI:18220) is a isoflavones (CHEBI:38757)
Incoming Relation(s)
3',4'-dihydroxyisoflavone (CHEBI:69476) has functional parent isoflavone (CHEBI:18220)
4'-O-methylisoflavone (CHEBI:1734) has functional parent isoflavone (CHEBI:18220)
5,6,7,4'-tetramethoxyisoflavone (CHEBI:79596) has functional parent isoflavone (CHEBI:18220)
7-[β-D-apiofuranosyl-(1→6)-β-D-glucopyranosyloxy]isoflavone (CHEBI:55464) has functional parent isoflavone (CHEBI:18220)
7-hydroxy-2',4',5'-trimethoxyisoflavone (CHEBI:80369) has functional parent isoflavone (CHEBI:18220)
7-hydroxy-5-methoxy-6,8-dimethylisoflavone (CHEBI:70652) has functional parent isoflavone (CHEBI:18220)
afrormosin (CHEBI:2506) has functional parent isoflavone (CHEBI:18220)
betavulgarin (CHEBI:3081) has functional parent isoflavone (CHEBI:18220)
calycosin (CHEBI:17793) has functional parent isoflavone (CHEBI:18220)
dalpatein (CHEBI:55549) has functional parent isoflavone (CHEBI:18220)
glycitein (CHEBI:34778) has functional parent isoflavone (CHEBI:18220)
irigenin (CHEBI:81409) has functional parent isoflavone (CHEBI:18220)
isoderrone (CHEBI:69748) has functional parent isoflavone (CHEBI:18220)
isowighteone (CHEBI:69749) has functional parent isoflavone (CHEBI:18220)
licoricone (CHEBI:69094) has functional parent isoflavone (CHEBI:18220)
orobol (CHEBI:69437) has functional parent isoflavone (CHEBI:18220)
paniculatin (CHEBI:7910) has functional parent isoflavone (CHEBI:18220)
piscerythramine (CHEBI:8251) has functional parent isoflavone (CHEBI:18220)
pisonianone (CHEBI:67366) has functional parent isoflavone (CHEBI:18220)
puerarin (CHEBI:8633) has functional parent isoflavone (CHEBI:18220)
tectorigenin (CHEBI:9429) has functional parent isoflavone (CHEBI:18220)
wighteone (CHEBI:10038) has functional parent isoflavone (CHEBI:18220)
IUPAC Name 
3-phenyl-4H-chromen-4-one
Synonyms  Source
3-phenyl-4H-1-benzopyran-4-oneChemIDplus
3-PhenylchromoneKEGG COMPOUND
IsoflavonChEBI
IsoflavoneKEGG COMPOUND
NSC-135405ChEMBL
Manual XrefsDatabases
C00799KEGG COMPOUND
LMPK12050000LIPID MAPS
Registry NumbersSources
Gmelin:1224833Gmelin
Reaxys:157731Reaxys
CAS:574-12-9ChemIDplus
Citations