EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:161225 - Met-Val-Lys

Default Structure
ChEBI IDCHEBI:161225
ChEBI NameMet-Val-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H32N4O4S
Net Charge0
Average Mass376.523
Monoisotopic Mass376.21443
SMILESCSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C
InChIInChI=1S/C16H32N4O4S/c1-10(2)13(20-14(21)11(18)7-9-25-3)15(22)19-12(16(23)24)6-4-5-8-17/h10-13H,4-9,17-18H2,1-3H3,(H,19,22)(H,20,21)(H,23,24)/t11-,12-,13-/m0/s1
InChIKeyLPNWWHBFXPNHJG-AVGNSLFASA-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-Val-Lys (CHEBI:161225) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-methylbutanoyl]amino]hexanoic acid
Manual XrefsDatabases
16573398ChemSpider