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CHEBI:132957 - N-acetylmethioninate

Default Structure
ChEBI IDCHEBI:132957
ChEBI NameN-acetylmethioninate
Stars
ASCII NameN-acetylmethioninate
DefinitionA monocarboxylic acid anion that is the conjugate base of N-acetylmethionine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified9 August 2016
SubmitterSteve
DownloadsMolfile
FormulaC7H12NO3S
Net Charge-1
Average Mass190.244
Monoisotopic Mass190.05434
SMILESCSCCC(NC(C)=O)C(=O)[O-]
InChIInChI=1S/C7H13NO3S/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/p-1
InChIKeyXUYPXLNMDZIRQH-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
N-acetylmethioninate (CHEBI:132957) is a monocarboxylic acid anion (CHEBI:35757)
N-acetylmethioninate (CHEBI:132957) is conjugate base of N-acetylmethionine (CHEBI:132958)
Incoming Relation(s)
N-acetyl-D-methionine(1−) (CHEBI:85220) is a N-acetylmethioninate (CHEBI:132957)
N-acetyl-L-methionine(1−) (CHEBI:71670) is a N-acetylmethioninate (CHEBI:132957)
N-acetylmethionine (CHEBI:132958) is conjugate acid of N-acetylmethioninate (CHEBI:132957)
IUPAC Name 
2-acetamido-4-(methylsulfanyl)butanoate
Synonyms  Source
Ac-Met(1−)ChEBI
N-acetylmethionine(1−)ChEBI
N-Ac-Met(1−)ChEBI