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CHEBI:161168 - Cys-Asn-Lys

ChEBI IDCHEBI:161168
ChEBI NameCys-Asn-Lys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H25N5O5S
Net Charge0
Average Mass363.440
Monoisotopic Mass363.15764
SMILESNCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C13H25N5O5S/c14-4-2-1-3-8(13(22)23)17-12(21)9(5-10(16)19)18-11(20)7(15)6-24/h7-9,24H,1-6,14-15H2,(H2,16,19)(H,17,21)(H,18,20)(H,22,23)/t7-,8-,9-/m0/s1
InChIKeyWVJHEDOLHPZLRV-CIUDSAMLSA-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-Asn-Lys (CHEBI:161168) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-oxobutanoyl]amino]hexanoic acid
Manual XrefsDatabases
16570009ChemSpider