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CHEBI:160787 - Met-His-Lys

Default Structure
ChEBI IDCHEBI:160787
ChEBI NameMet-His-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H30N6O4S
Net Charge0
Average Mass414.532
Monoisotopic Mass414.20492
SMILESCSCC[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](CCCCN)C(=O)O
InChIInChI=1S/C17H30N6O4S/c1-28-7-5-12(19)15(24)23-14(8-11-9-20-10-21-11)16(25)22-13(17(26)27)4-2-3-6-18/h9-10,12-14H,2-8,18-19H2,1H3,(H,20,21)(H,22,25)(H,23,24)(H,26,27)/t12-,13-,14-/m0/s1
InChIKeyDYTWOWJWJCBFLE-IHRRRGAJSA-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-His-Lys (CHEBI:160787) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoic acid
Manual XrefsDatabases
16573181ChemSpider