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CHEBI:166149 - Val-Cys-Thr

ChEBI IDCHEBI:166149
ChEBI NameVal-Cys-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O5S
Net Charge0
Average Mass321.399
Monoisotopic Mass321.13584
SMILESCC(C)[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C12H23N3O5S/c1-5(2)8(13)11(18)14-7(4-21)10(17)15-9(6(3)16)12(19)20/h5-9,16,21H,4,13H2,1-3H3,(H,14,18)(H,15,17)(H,19,20)/t6-,7+,8+,9+/m1/s1
InChIKeyIRLYZKKNBFPQBW-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)
Val-Cys-Thr (CHEBI:166149) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2R)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-sulanylpropanoyl]amino]-3-hydroxybutanoic acid