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CHEBI:161078 - Cys-Ala-Glu

ChEBI IDCHEBI:161078
ChEBI NameCys-Ala-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H19N3O6S
Net Charge0
Average Mass321.355
Monoisotopic Mass321.09946
SMILESC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C11H19N3O6S/c1-5(13-10(18)6(12)4-21)9(17)14-7(11(19)20)2-3-8(15)16/h5-7,21H,2-4,12H2,1H3,(H,13,18)(H,14,17)(H,15,16)(H,19,20)/t5-,6-,7-/m0/s1
InChIKeyGRNOCLDFUNCIDW-ACZMJKKPSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Cys-Ala-Glu (CHEBI:161078) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]propanoyl]amino]pentanedioic acid