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CHEBI:160486 - Met-Ala-Val

ChEBI IDCHEBI:160486
ChEBI NameMet-Ala-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H25N3O4S
Net Charge0
Average Mass319.427
Monoisotopic Mass319.15658
SMILESCSCC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C13H25N3O4S/c1-7(2)10(13(19)20)16-11(17)8(3)15-12(18)9(14)5-6-21-4/h7-10H,5-6,14H2,1-4H3,(H,15,18)(H,16,17)(H,19,20)/t8-,9-,10-/m0/s1
InChIKeyDTICLBJHRYSJLH-GUBZILKMSA-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-Ala-Val (CHEBI:160486) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]propanoyl]amino]-3-methylbutanoic acid