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CHEBI:162210 - Pro-Cys-Thr

ChEBI IDCHEBI:162210
ChEBI NamePro-Cys-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21N3O5S
Net Charge0
Average Mass319.383
Monoisotopic Mass319.12019
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C12H21N3O5S/c1-6(16)9(12(19)20)15-11(18)8(5-21)14-10(17)7-3-2-4-13-7/h6-9,13,16,21H,2-5H2,1H3,(H,14,17)(H,15,18)(H,19,20)/t6-,7+,8+,9+/m1/s1
InChIKeyXJROSHJRQTXWAE-XGEHTFHBSA-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)
Pro-Cys-Thr (CHEBI:162210) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-3-hydroxy-2-[[(2R)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]-3-sulanylpropanoyl]amino]butanoic acid