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CHEBI:161293 - Cys-Gln-Thr

ChEBI IDCHEBI:161293
ChEBI NameCys-Gln-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O6S
Net Charge0
Average Mass350.397
Monoisotopic Mass350.12601
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C12H22N4O6S/c1-5(17)9(12(21)22)16-11(20)7(2-3-8(14)18)15-10(19)6(13)4-23/h5-7,9,17,23H,2-4,13H2,1H3,(H2,14,18)(H,15,19)(H,16,20)(H,21,22)/t5-,6+,7+,9+/m1/s1
InChIKeyUCMIKRLLIOVDRJ-XKBZYTNZSA-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-Gln-Thr (CHEBI:161293) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-5-amino-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoic acid