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CHEBI:161038 - Met-Pro-Thr

ChEBI IDCHEBI:161038
ChEBI NameMet-Pro-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H25N3O5S
Net Charge0
Average Mass347.437
Monoisotopic Mass347.15149
SMILESCSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C14H25N3O5S/c1-8(18)11(14(21)22)16-12(19)10-4-3-6-17(10)13(20)9(15)5-7-23-2/h8-11,18H,3-7,15H2,1-2H3,(H,16,19)(H,21,22)/t8-,9+,10+,11+/m1/s1
InChIKeyLUYURUYVNYGKGM-RCWTZXSCSA-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-Pro-Thr (CHEBI:161038) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-1-[(2S)-2-amino-4-methylsulanylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid