CHEBI:28759 - 3-oxo-3-phenylpropionic acid

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ChEBI Name 3-oxo-3-phenylpropionic acid ChEBI ID CHEBI:28759 Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:3036 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H8O3 Net Charge 0 Average Mass 164.15802 Monoisotopic Mass 164.04734 InChI InChI=1S/C9H8O3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) InChIKey HXUIDZOMTRMIOE-UHFFFAOYSA-N SMILES OC(=O)CC(=O)c1ccccc1 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3-oxo-3-phenylpropionic acid (CHEBI:28759) is a 3-oxo monocarboxylic acid (CHEBI:47881) 3-oxo-3-phenylpropionic acid (CHEBI:28759) is conjugate acid of 3-oxo-3-phenylpropionate (CHEBI:22731) Incoming benzoylacetyl-CoA (CHEBI:27388) has functional parent 3-oxo-3-phenylpropionic acid (CHEBI:28759) 3-oxo-3-phenylpropionate (CHEBI:22731) is conjugate base of 3-oxo-3-phenylpropionic acid (CHEBI:28759) IUPAC Name 3-oxo-3-phenylpropanoic acid Synonyms Sources 3-keto-3-phenylpropionic acid ChemIDplus benzoylacetic acid ChEBI Manual Xref Database C07114 KEGG COMPOUND View more database links Registry Numbers Types Sources 2058740 Gmelin Registry Number Gmelin 2207336 Beilstein Registry Number Beilstein 614-20-0 CAS Registry Number ChemIDplus Last Modified 22 July 2011