EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164176 - Thr-Pro-Cys

ChEBI IDCHEBI:164176
ChEBI NameThr-Pro-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21N3O5S
Net Charge0
Average Mass319.383
Monoisotopic Mass319.12019
SMILESC[C@@H](O)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C12H21N3O5S/c1-6(16)9(13)11(18)15-4-2-3-8(15)10(17)14-7(5-21)12(19)20/h6-9,16,21H,2-5,13H2,1H3,(H,14,17)(H,19,20)/t6-,7+,8+,9+/m1/s1
InChIKeyDNCUODYZAMHLCV-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)
Thr-Pro-Cys (CHEBI:164176) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-3-sulanylpropanoic acid