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CHEBI:191038 - Dihydroketoprofen

ChEBI IDCHEBI:191038
ChEBI NameDihydroketoprofen
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O3
Net Charge0
Average Mass256.301
Monoisotopic Mass256.10994
SMILESCC(C(=O)O)C1C=CC=C(C(=O)c2ccccc2)C1
InChIInChI=1S/C16H16O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-9,11,13H,10H2,1H3,(H,18,19)
InChIKeyCOQHFALLBPGIMO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
Dihydroketoprofen (CHEBI:191038) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
2-(5-benzoylcyclohexa-2,4-dien-1-yl)propanoic acid
Manual XrefsDatabases
67154845ChemSpider