EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:161301 - Cys-Glu-Ala

ChEBI IDCHEBI:161301
ChEBI NameCys-Glu-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H19N3O6S
Net Charge0
Average Mass321.355
Monoisotopic Mass321.09946
SMILESC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C11H19N3O6S/c1-5(11(19)20)13-10(18)7(2-3-8(15)16)14-9(17)6(12)4-21/h5-7,21H,2-4,12H2,1H3,(H,13,18)(H,14,17)(H,15,16)(H,19,20)/t5-,6-,7-/m0/s1
InChIKeyYUZPQIQWXLRFBW-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-Glu-Ala (CHEBI:161301) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-5-[[(1S)-1-carboxyethyl]amino]-5-oxopentanoic acid