EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:159793 - Lys-Asp-Cys

ChEBI IDCHEBI:159793
ChEBI NameLys-Asp-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24N4O6S
Net Charge0
Average Mass364.424
Monoisotopic Mass364.14166
SMILESNCCCC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C13H24N4O6S/c14-4-2-1-3-7(15)11(20)16-8(5-10(18)19)12(21)17-9(6-24)13(22)23/h7-9,24H,1-6,14-15H2,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t7-,8-,9-/m0/s1
InChIKeySQXUUGUCGJSWCK-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)
Lys-Asp-Cys (CHEBI:159793) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-4-[[(1R)-1-carboxy-2-sulanylethyl]amino]-3-[[(2S)-2,6-diaminohexanoyl]amino]-4-oxobutanoic acid