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CHEBI:194372 - N-acetyl-S-phenyl-L-cysteine(1−)

ChEBI IDCHEBI:194372
ChEBI NameN-acetyl-S-phenyl-L-cysteine(1−)
Stars
ASCII NameN-acetyl-S-phenyl-L-cysteine(1-)
DefinitionAn S-substituted N-acetyl-L-cysteinate that is the conjugate base of N-acetyl-S-phenyl-L-cysteine resulting from the deprotonation of the carboxy group; major species at pH 7.3.
Last Modified10 February 2023
SubmitterAdnan
DownloadsMolfile
FormulaC11H12NO3S
Net Charge-1
Average Mass238.288
Monoisotopic Mass238.05434
SMILESCC(=O)N[C@@H](CSc1ccccc1)C(=O)[O-]
InChIInChI=1S/C11H13NO3S/c1-8(13)12-10(11(14)15)7-16-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)/p-1/t10-/m0/s1
InChIKeyCICOZWHZVMOPJS-JTQLQIEISA-M
ChEBI Ontology
Outgoing Relation(s)
N-acetyl-S-phenyl-L-cysteine(1−) (CHEBI:194372) is a S-substituted N-acetyl-L-cysteinate (CHEBI:58718)
N-acetyl-S-phenyl-L-cysteine(1−) (CHEBI:194372) is conjugate base of N-acetyl-S-phenyl-L-cysteine (CHEBI:165887)
Incoming Relation(s)
N-acetyl-S-phenyl-L-cysteine (CHEBI:165887) is conjugate acid of N-acetyl-S-phenyl-L-cysteine(1−) (CHEBI:194372)
IUPAC Name 
(2R)-2-acetamido-3-(phenylsulfanyl)propanoate
Synonyms  Source
N-acetyl-S-phenyl-L-cysteine anionChEBI
S-phenylmercapturateChEBI
phenylmercapturateChEBI
(R)-2-acetamido-3-(phenylthio)propanoateChEBI