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CHEBI:22731 - 3-oxo-3-phenylpropionate

ChEBI IDCHEBI:22731
ChEBI Name3-oxo-3-phenylpropionate
Stars
Last Modified21 August 2015
DownloadsMolfile
FormulaC9H7O3
Net Charge-1
Average Mass163.152
Monoisotopic Mass163.04007
SMILESO=C([O-])CC(=O)c1ccccc1
InChIInChI=1S/C9H8O3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)/p-1
InChIKeyHXUIDZOMTRMIOE-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-oxo-3-phenylpropionate (CHEBI:22731) is a oxo monocarboxylic acid anion (CHEBI:35902)
3-oxo-3-phenylpropionate (CHEBI:22731) is conjugate base of 3-oxo-3-phenylpropionic acid (CHEBI:28759)
Incoming Relation(s)
3-oxo-3-phenylpropionic acid (CHEBI:28759) is conjugate acid of 3-oxo-3-phenylpropionate (CHEBI:22731)
IUPAC Name 
3-oxo-3-phenylpropanoate
UniProt Name  Source
3-oxo-3-phenylpropanoateUniProt
Manual XrefsDatabases
c0267UM-BBD
Registry NumbersSources
Gmelin:102239Gmelin
Beilstein:4988854Beilstein
CAS:29285-17-4UM-BBD