EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:158510 - Ile-Ile-Leu

ChEBI IDCHEBI:158510
ChEBI NameIle-Ile-Leu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H35N3O4
Net Charge0
Average Mass357.495
Monoisotopic Mass357.26276
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC
InChIInChI=1S/C18H35N3O4/c1-7-11(5)14(19)16(22)21-15(12(6)8-2)17(23)20-13(18(24)25)9-10(3)4/h10-15H,7-9,19H2,1-6H3,(H,20,23)(H,21,22)(H,24,25)/t11-,12-,13-,14-,15-/m0/s1
InChIKeyTWPSALMCEHCIOY-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)
Ile-Ile-Leu (CHEBI:158510) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid