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CHEBI:158790 - Ile-Thr-Lys

ChEBI IDCHEBI:158790
ChEBI NameIle-Thr-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H32N4O5
Net Charge0
Average Mass360.455
Monoisotopic Mass360.23727
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O
InChIInChI=1S/C16H32N4O5/c1-4-9(2)12(18)14(22)20-13(10(3)21)15(23)19-11(16(24)25)7-5-6-8-17/h9-13,21H,4-8,17-18H2,1-3H3,(H,19,23)(H,20,22)(H,24,25)/t9-,10+,11-,12-,13-/m0/s1
InChIKeyQGXQHJQPAPMACW-PPCPHDFISA-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-Thr-Lys (CHEBI:158790) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoic acid
Manual XrefsDatabases
16572203ChemSpider