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CHEBI:194347 - N-acetyl-S-methyl-L-cysteine(1−)

Default Structure
ChEBI IDCHEBI:194347
ChEBI NameN-acetyl-S-methyl-L-cysteine(1−)
Stars
ASCII NameN-acetyl-S-methyl-L-cysteine(1-)
DefinitionAn S-substituted N-acetyl-L-cysteinate that is the conjugate base of N-acetyl-S-methyl-L-cysteine resulting from the deprotonation of the carboxy group; major species at pH 7.3.
Last Modified9 February 2023
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC6H10NO3S
Net Charge-1
Average Mass176.217
Monoisotopic Mass176.03869
SMILESCSC[C@H](NC(C)=O)C(=O)[O-]
InChIInChI=1S/C6H11NO3S/c1-4(8)7-5(3-11-2)6(9)10/h5H,3H2,1-2H3,(H,7,8)(H,9,10)/p-1/t5-/m0/s1
InChIKeyRYGLCORNOFFGTB-YFKPBYRVSA-M
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-S-methyl-L-cysteine(1−) (CHEBI:194347) is a S-substituted N-acetyl-L-cysteinate (CHEBI:58718)
N-acetyl-S-methyl-L-cysteine(1−) (CHEBI:194347) is conjugate base of N-acetyl-S-methyl-L-cysteine (CHEBI:194359)
Incoming Relation(s)
N-acetyl-S-methyl-L-cysteine (CHEBI:194359) is conjugate acid of N-acetyl-S-methyl-L-cysteine(1−) (CHEBI:194347)
IUPAC Name 
(2R)-2-acetamido-3-(methylsulfanyl)propanoate
Synonyms  Source
(2R)-2-acetamido-3-methylsulfanylpropanoateChEBI
N-acetyl-S-methyl-L-cysteine anionChEBI
S-methylmercapturateChEBI
UniProt Name  Source
N-acetyl-S-methyl-L-cysteineUniProt
Manual XrefsDatabases
CPD-26168MetaCyc
Citations