Terminology Service for NFDI4Health
4-oxo-4-phenylbutyric acid
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http://purl.obolibrary.org/obo/CHEBI_64437
A 4-oxo monocarboxylic acid that is butyric acid bearing oxo and phenyl substituents at position 4.
Term info
Label
4-oxo-4-phenylbutyric acid
Synonyms
- 4-oxo-4-phenylbutanoic acid
Subsets
3_STAR
charge
0
formula
C10H10O3
has obo namespace
chebi_ontology
has related synonym
Benzoylpropionic acid, 3-Benzoylpropionic acid, beta-Benzoylpropionic acid, 3-Benzoylpropanoic acid
id
CHEBI:64437
inchi
InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)
inchikey
KMQLIDDEQAJAGJ-UHFFFAOYSA-N
mass
178.18460
monoisotopicmass
178.06299
smiles
OC(=O)CCC(=O)c1ccccc1