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CHEBI:163791 - Thr-Cys-Met

ChEBI IDCHEBI:163791
ChEBI NameThr-Cys-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H23N3O5S2
Net Charge0
Average Mass353.466
Monoisotopic Mass353.10791
SMILESCSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O
InChIInChI=1S/C12H23N3O5S2/c1-6(16)9(13)11(18)15-8(5-21)10(17)14-7(12(19)20)3-4-22-2/h6-9,16,21H,3-5,13H2,1-2H3,(H,14,17)(H,15,18)(H,19,20)/t6-,7+,8+,9+/m1/s1
InChIKeyNRBUKAHTWRCUEQ-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-Cys-Met (CHEBI:163791) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-sulanylpropanoyl]amino]-4-methylsulanylbutanoic acid