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CHEBI:161093 - Met-Thr-Asp

ChEBI IDCHEBI:161093
ChEBI NameMet-Thr-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H23N3O7S
Net Charge0
Average Mass365.408
Monoisotopic Mass365.12567
SMILESCSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O
InChIInChI=1S/C13H23N3O7S/c1-6(17)10(16-11(20)7(14)3-4-24-2)12(21)15-8(13(22)23)5-9(18)19/h6-8,10,17H,3-5,14H2,1-2H3,(H,15,21)(H,16,20)(H,18,19)(H,22,23)/t6-,7+,8+,10+/m1/s1
InChIKeyKYXDADPHSNFWQX-VEVYYDQMSA-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)
Met-Thr-Asp (CHEBI:161093) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-hydroxybutanoyl]amino]butanedioic acid
Manual XrefsDatabases
8331222ChemSpider