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CHEBI:73960 - 1-phenyl-3-(phenylsulfonyl)-2-propen-1-one

ChEBI IDCHEBI:73960
ChEBI Name1-phenyl-3-(phenylsulfonyl)-2-propen-1-one
Stars
DefinitionA sulfone that is 1-phenyl-2-propenone with a phenylsulfonyl group at position 3.
Last Modified7 November 2013
Submittermwilliams
DownloadsMolfile
FormulaC15H12O3S
Net Charge0
Average Mass272.325
Monoisotopic Mass272.05072
SMILESO=C(/C=C/S(=O)(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H12O3S/c16-15(13-7-3-1-4-8-13)11-12-19(17,18)14-9-5-2-6-10-14/h1-12H/b12-11+
InChIKeyKPWYLVJFIPLFCW-VAWYXSNFSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
1-phenyl-3-(phenylsulfonyl)-2-propen-1-one (CHEBI:73960) has role metabolite (CHEBI:25212)
1-phenyl-3-(phenylsulfonyl)-2-propen-1-one (CHEBI:73960) is a aromatic ketone (CHEBI:76224)
1-phenyl-3-(phenylsulfonyl)-2-propen-1-one (CHEBI:73960) is a enone (CHEBI:51689)
1-phenyl-3-(phenylsulfonyl)-2-propen-1-one (CHEBI:73960) is a sulfone (CHEBI:35850)
IUPAC Name 
(2E)-1-phenyl-3-(phenylsulfonyl)prop-2-en-1-one
Synonym  Source
3-(Phenylsulfonyl)acrylophenoneKEGG COMPOUND
Manual XrefsDatabases
C15077KEGG COMPOUND
Registry NumbersSources
Reaxys:2214675Reaxys