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CHEBI:161045 - Met-Pro-Val

ChEBI IDCHEBI:161045
ChEBI NameMet-Pro-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27N3O4S
Net Charge0
Average Mass345.465
Monoisotopic Mass345.17223
SMILESCSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C15H27N3O4S/c1-9(2)12(15(21)22)17-13(19)11-5-4-7-18(11)14(20)10(16)6-8-23-3/h9-12H,4-8,16H2,1-3H3,(H,17,19)(H,21,22)/t10-,11-,12-/m0/s1
InChIKeyBJPQKNHZHUCQNQ-SRVKXCTJSA-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-Val (CHEBI:161045) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-1-[(2S)-2-amino-4-methylsulanylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-methylbutanoic acid