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CHEBI:161739 - Cys-Thr-Val

ChEBI IDCHEBI:161739
ChEBI NameCys-Thr-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O5S
Net Charge0
Average Mass321.399
Monoisotopic Mass321.13584
SMILESCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)O
InChIInChI=1S/C12H23N3O5S/c1-5(2)8(12(19)20)14-11(18)9(6(3)16)15-10(17)7(13)4-21/h5-9,16,21H,4,13H2,1-3H3,(H,14,18)(H,15,17)(H,19,20)/t6-,7+,8+,9+/m1/s1
InChIKeyKFYPRIGJTICABD-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)
Cys-Thr-Val (CHEBI:161739) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoic acid