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CHEBI:163737 - Thr-Asp-Cys

Default Structure
ChEBI IDCHEBI:163737
ChEBI NameThr-Asp-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H19N3O7S
Net Charge0
Average Mass337.354
Monoisotopic Mass337.09437
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C11H19N3O7S/c1-4(15)8(12)10(19)13-5(2-7(16)17)9(18)14-6(3-22)11(20)21/h4-6,8,15,22H,2-3,12H2,1H3,(H,13,19)(H,14,18)(H,16,17)(H,20,21)/t4-,5+,6+,8+/m1/s1
InChIKeyNLJKZUGAIIRWJN-LKXGYXEUSA-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-Asp-Cys (CHEBI:163737) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-[[(1R)-1-carboxy-2-sulanylethyl]amino]-4-oxobutanoic acid