CHEBI:133520 - N-acetyl-L-alaninate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-acetyl-L-alaninate
ChEBI ID CHEBI:133520
ChEBI ASCII Name N-acetyl-L-alaninate
Definition A monocarboxylic acid anion that is the conjugate base of N-acetyl-L-alanine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C5H8NO3
Net Charge -1
Average Mass 130.122
Monoisotopic Mass 130.05097
InChI InChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)/p-1/t3-/m0/s1
InChIKey KTHDTJVBEPMMGL-VKHMYHEASA-M
SMILES O=C([O-])[C@@H](NC(=O)C)C
ChEBI Ontology
Outgoing N-acetyl-L-alaninate (CHEBI:133520) is a N-acyl-L-α-amino acid anion (CHEBI:59874)
N-acetyl-L-alaninate (CHEBI:133520) is a monocarboxylic acid anion (CHEBI:35757)
N-acetyl-L-alaninate (CHEBI:133520) is conjugate base of N-acetyl-L-alanine (CHEBI:40992)
Incoming N-acetyl-L-alanine (CHEBI:40992) is conjugate acid of N-acetyl-L-alaninate (CHEBI:133520)
IUPAC Name
(2S)-2-acetamidopropanoate
Synonym Source
N-acetylalaninate ChEBI
Registry Number Type Source
4131390 Reaxys Registry Number Reaxys
Last Modified
11 October 2016