EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:161695 - Phe-Lys-Lys

ChEBI IDCHEBI:161695
ChEBI NamePhe-Lys-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H35N5O4
Net Charge0
Average Mass421.542
Monoisotopic Mass421.26890
SMILESNCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C21H35N5O4/c22-12-6-4-10-17(20(28)26-18(21(29)30)11-5-7-13-23)25-19(27)16(24)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
InChIKeyPEFJUUYFEGBXFA-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)
Phe-Lys-Lys (CHEBI:161695) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]hexanoyl]amino]hexanoic acid
Manual XrefsDatabases
16573628ChemSpider