EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:160037 - Lys-Ile-Ile

ChEBI IDCHEBI:160037
ChEBI NameLys-Ile-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H36N4O4
Net Charge0
Average Mass372.510
Monoisotopic Mass372.27366
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(=O)O
InChIInChI=1S/C18H36N4O4/c1-5-11(3)14(21-16(23)13(20)9-7-8-10-19)17(24)22-15(18(25)26)12(4)6-2/h11-15H,5-10,19-20H2,1-4H3,(H,21,23)(H,22,24)(H,25,26)/t11-,12-,13-,14-,15-/m0/s1
InChIKeyJYXBNQOKPRQNQS-YTFOTSKYSA-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)
Lys-Ile-Ile (CHEBI:160037) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S,3S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-methylpentanoyl]amino]-3-methylpentanoic acid