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CHEBI:71166 - N-benzoyl-L-alanine

ChEBI IDCHEBI:71166
ChEBI NameN-benzoyl-L-alanine
Stars
ASCII NameN-benzoyl-L-alanine
DefinitionAn N-acyl-L-alanine resulting from the formal condensation of L-alanine with the carboxy group of benzoic acid.
Last Modified13 April 2015
SubmitterSteve
DownloadsMolfile
FormulaC10H11NO3
Net Charge0
Average Mass193.202
Monoisotopic Mass193.07389
SMILESC[C@H](NC(=O)c1ccccc1)C(=O)O
InChIInChI=1S/C10H11NO3/c1-7(10(13)14)11-9(12)8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12)(H,13,14)/t7-/m0/s1
InChIKeyUAQVHNZEONHPQG-ZETCQYMHSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
N-benzoyl-L-alanine (CHEBI:71166) has role metabolite (CHEBI:25212)
N-benzoyl-L-alanine (CHEBI:71166) is a N-acyl-L-alanine (CHEBI:83946)
N-benzoyl-L-alanine (CHEBI:71166) is a N-benzoylalanine (CHEBI:71167)
IUPAC Name 
N-benzoyl-L-alanine
Synonyms  Source
N-BenzoylalanineChemIDplus
Methylhippuric acidChemIDplus
(S)-α-methylhippuric acidChEBI
Registry NumbersSources
Reaxys:2330961Reaxys
CAS:2198-64-3ChemIDplus
Citations