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CHEBI:160598 - Met-Asp-Thr

ChEBI IDCHEBI:160598
ChEBI NameMet-Asp-Thr
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](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C13H23N3O7S/c1-6(17)10(13(22)23)16-12(21)8(5-9(18)19)15-11(20)7(14)3-4-24-2/h6-8,10,17H,3-5,14H2,1-2H3,(H,15,20)(H,16,21)(H,18,19)(H,22,23)/t6-,7+,8+,10+/m1/s1
InChIKeyMCNGIXXCMJAURZ-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-Asp-Thr (CHEBI:160598) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-4-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-4-oxobutanoic acid