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CHEBI:158574 - Ile-Lys-Asn

ChEBI IDCHEBI:158574
ChEBI NameIle-Lys-Asn
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H31N5O5
Net Charge0
Average Mass373.454
Monoisotopic Mass373.23252
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C16H31N5O5/c1-3-9(2)13(19)15(24)20-10(6-4-5-7-17)14(23)21-11(16(25)26)8-12(18)22/h9-11,13H,3-8,17,19H2,1-2H3,(H2,18,22)(H,20,24)(H,21,23)(H,25,26)/t9-,10-,11-,13-/m0/s1
InChIKeyOVDKXUDMKXAZIV-ZPFDUUQYSA-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-Asn (CHEBI:158574) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-6-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]hexanoyl]amino]-4-oxobutanoic acid