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CHEBI:159941 - Asn-Lys-Phe

ChEBI IDCHEBI:159941
ChEBI NameAsn-Lys-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H29N5O5
Net Charge0
Average Mass407.471
Monoisotopic Mass407.21687
SMILESNCCCC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C19H29N5O5/c20-9-5-4-8-14(23-17(26)13(21)11-16(22)25)18(27)24-15(19(28)29)10-12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8-11,20-21H2,(H2,22,25)(H,23,26)(H,24,27)(H,28,29)/t13-,14-,15-/m0/s1
InChIKeyWXVGISRWSYGEDK-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)
Asn-Lys-Phe (CHEBI:159941) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-6-amino-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]hexanoyl]amino]-3-phenylpropanoic acid