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CHEBI:161519 - Cys-Lys-Ile

ChEBI IDCHEBI:161519
ChEBI NameCys-Lys-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H30N4O4S
Net Charge0
Average Mass362.496
Monoisotopic Mass362.19878
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C15H30N4O4S/c1-3-9(2)12(15(22)23)19-14(21)11(6-4-5-7-16)18-13(20)10(17)8-24/h9-12,24H,3-8,16-17H2,1-2H3,(H,18,20)(H,19,21)(H,22,23)/t9-,10-,11-,12-/m0/s1
InChIKeyYXPNKXFOBHRUBL-BJDJZHNGSA-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)
Cys-Lys-Ile (CHEBI:161519) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-6-amino-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]hexanoyl]amino]-3-methylpentanoic acid