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CHEBI:165885 - N-Acetyl-S-(3-oxo-3-carboxy-n-propyl)cysteine

ChEBI IDCHEBI:165885
ChEBI NameN-Acetyl-S-(3-oxo-3-carboxy-n-propyl)cysteine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H13NO6S
Net Charge0
Average Mass263.271
Monoisotopic Mass263.04636
SMILESCC(=O)N[C@@H](CSCCC(=O)C(=O)O)C(=O)O
InChIInChI=1S/C9H13NO6S/c1-5(11)10-6(8(13)14)4-17-3-2-7(12)9(15)16/h6H,2-4H2,1H3,(H,10,11)(H,13,14)(H,15,16)/t6-/m0/s1
InChIKeyAHFWWWFNCBRMIV-LURJTMIESA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-Acetyl-S-(3-oxo-3-carboxy-n-propyl)cysteine (CHEBI:165885) is a N-acyl-L-amino acid (CHEBI:21644)
IUPAC Name 
4-[(2R)-2-acetamido-2-carboxyethyl]sulanyl-2-oxobutanoic acid
Manual XrefsDatabases
13628313ChemSpider
HMDB0002194HMDB