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CHEBI:158596 - Ile-Lys-Phe

ChEBI IDCHEBI:158596
ChEBI NameIle-Lys-Phe
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H34N4O4
Net Charge0
Average Mass406.527
Monoisotopic Mass406.25801
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C21H34N4O4/c1-3-14(2)18(23)20(27)24-16(11-7-8-12-22)19(26)25-17(21(28)29)13-15-9-5-4-6-10-15/h4-6,9-10,14,16-18H,3,7-8,11-13,22-23H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)/t14-,16-,17-,18-/m0/s1
InChIKeyIDMNOFVUXYYZPF-DKIMLUQUSA-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-Lys-Phe (CHEBI:158596) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-6-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]hexanoyl]amino]-3-phenylpropanoic acid