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CHEBI:165880 - N-Acetyl-S-(2-hydroxy-3-butenyl)cysteine

ChEBI IDCHEBI:165880
ChEBI NameN-Acetyl-S-(2-hydroxy-3-butenyl)cysteine
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SubmitterMetaboLights
DownloadsMolfile
FormulaC9H15NO4S
Net Charge0
Average Mass233.289
Monoisotopic Mass233.07218
SMILESC=CC(O)CSC[C@H](NC(C)=O)C(=O)O
InChIInChI=1S/C9H15NO4S/c1-3-7(12)4-15-5-8(9(13)14)10-6(2)11/h3,7-8,12H,1,4-5H2,2H3,(H,10,11)(H,13,14)/t7?,8-/m0/s1
InChIKeyFKFOCGZWTJHIGU-MQWKRIRWSA-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-(2-hydroxy-3-butenyl)cysteine (CHEBI:165880) is a N-acyl-L-amino acid (CHEBI:21644)
IUPAC Name 
(2R)-2-acetamido-3-(2-hydroxybut-3-enylsulanyl)propanoic acid
Manual XrefsDatabases
57558644ChemSpider