CHEBI:181422 - 2-Oxo-4-phenylbutyric acid

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ChEBI Name 2-Oxo-4-phenylbutyric acid
ChEBI ID CHEBI:181422
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H10O3
Net Charge 0
Average Mass 178.187
Monoisotopic Mass 178.06299
InChI InChI=1S/C10H10O3/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)
InChIKey PPKAIMDMNWBOKN-UHFFFAOYSA-N
SMILES O=C(CCC1=CC=CC=C1)C(O)=O
ChEBI Ontology
Outgoing 2-Oxo-4-phenylbutyric acid (CHEBI:181422) is a benzenes (CHEBI:22712)
IUPAC Name
2-oxo-4-phenylbutanoic acid
Manual Xrefs Databases
62932 ChemSpider
C20327 KEGG COMPOUND
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Registry Number Type Source
710-11-2 CAS Registry Number ChemIDplus