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CHEBI:160122 - Lys-Lys-Phe

Default Structure
ChEBI IDCHEBI:160122
ChEBI NameLys-Lys-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H35N5O4
Net Charge0
Average Mass421.542
Monoisotopic Mass421.26890
SMILESNCCCC[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C21H35N5O4/c22-12-6-4-10-16(24)19(27)25-17(11-5-7-13-23)20(28)26-18(21(29)30)14-15-8-2-1-3-9-15/h1-3,8-9,16-18H,4-7,10-14,22-24H2,(H,25,27)(H,26,28)(H,29,30)/t16-,17-,18-/m0/s1
InChIKeyATNKHRAIZCMCCN-BZSNNMDCSA-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-Lys-Phe (CHEBI:160122) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-6-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]hexanoyl]amino]-3-phenylpropanoic acid
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