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CHEBI:160052 - Lys-Ile-Thr

Default Structure
ChEBI IDCHEBI:160052
ChEBI NameLys-Ile-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H32N4O5
Net Charge0
Average Mass360.455
Monoisotopic Mass360.23727
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C16H32N4O5/c1-4-9(2)12(15(23)20-13(10(3)21)16(24)25)19-14(22)11(18)7-5-6-8-17/h9-13,21H,4-8,17-18H2,1-3H3,(H,19,22)(H,20,23)(H,24,25)/t9-,10+,11-,12-,13-/m0/s1
InChIKeyNCZIQZYZPUPMKY-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)
Lys-Ile-Thr (CHEBI:160052) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S,3S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoic acid