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CHEBI:133716 - N-acetyl-L-valinate

ChEBI IDCHEBI:133716
ChEBI NameN-acetyl-L-valinate
Stars
ASCII NameN-acetyl-L-valinate
DefinitionA monocarboxylic acid anion that is the conjugate base of N-acetyl-L-valine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified8 August 2024
SubmitterSteve
DownloadsMolfile
FormulaC7H12NO3
Net Charge-1
Average Mass158.177
Monoisotopic Mass158.08227
SMILESCC(=O)N[C@H](C(=O)[O-])C(C)C
InChIInChI=1S/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)/p-1/t6-/m0/s1
InChIKeyIHYJTAOFMMMOPX-LURJTMIESA-M
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-L-valinate (CHEBI:133716) is a N-acyl-L-α-amino acid anion (CHEBI:59874)
N-acetyl-L-valinate (CHEBI:133716) is a monocarboxylic acid anion (CHEBI:35757)
N-acetyl-L-valinate (CHEBI:133716) is conjugate base of N-acetyl-L-valine (CHEBI:21565)
Incoming Relation(s)
N-acetyl-L-valine (CHEBI:21565) is conjugate acid of N-acetyl-L-valinate (CHEBI:133716)
IUPAC Name 
(2S)-2-acetamido-3-methylbutanoate
Synonym  Source
N-acetylvalinateChEBI
UniProt Name  Source
N-acetyl-L-valineUniProt
Registry NumbersSources
Reaxys:3941937Reaxys