EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:71972 - 4-phenylcoumarin

ChEBI IDCHEBI:71972
ChEBI Name4-phenylcoumarin
Stars
DefinitionThe simplest member of the class of neoflavones that is coumarin substituted by a phenyl group at position 4.
Last Modified17 February 2017
Submitternamrata
DownloadsMolfile
FormulaC15H10O2
Net Charge0
Average Mass222.243
Monoisotopic Mass222.06808
SMILESO=c1cc(-c2ccccc2)c2ccccc2o1
InChIInChI=1S/C15H10O2/c16-15-10-13(11-6-2-1-3-7-11)12-8-4-5-9-14(12)17-15/h1-10H
InChIKeySAZHWFFOFMSQPA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-phenylcoumarin (CHEBI:71972) is a neoflavones (CHEBI:72569)
IUPAC Name 
4-phenyl-2H-chromen-2-one
Synonyms  Source
4-phenyl-2H-1-benzopyran-2-oneChEBI
phenylcoumarinChEBI
Registry NumbersSources
Reaxys:157542Reaxys