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CHEBI:161717 - Cys-Thr-His

ChEBI IDCHEBI:161717
ChEBI NameCys-Thr-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H21N5O5S
Net Charge0
Average Mass359.408
Monoisotopic Mass359.12634
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C13H21N5O5S/c1-6(19)10(18-11(20)8(14)4-24)12(21)17-9(13(22)23)2-7-3-15-5-16-7/h3,5-6,8-10,19,24H,2,4,14H2,1H3,(H,15,16)(H,17,21)(H,18,20)(H,22,23)/t6-,8+,9+,10+/m1/s1
InChIKeyUKHNKRGNFKSHCG-CUJWVEQBSA-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-Thr-His (CHEBI:161717) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid