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CHEBI:160734 - Asp-Lys-Phe

Default Structure
ChEBI IDCHEBI:160734
ChEBI NameAsp-Lys-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28N4O6
Net Charge0
Average Mass408.455
Monoisotopic Mass408.20088
SMILESNCCCC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C19H28N4O6/c20-9-5-4-8-14(22-17(26)13(21)11-16(24)25)18(27)23-15(19(28)29)10-12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8-11,20-21H2,(H,22,26)(H,23,27)(H,24,25)(H,28,29)/t13-,14-,15-/m0/s1
InChIKeyYWLDTBBUHZJQHW-KKUMJFAQSA-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)
Asp-Lys-Phe (CHEBI:160734) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-6-amino-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-1-oxohexan-2-yl]amino]-4-oxobutanoic acid