EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:159855 - Lys-Cys-Thr

ChEBI IDCHEBI:159855
ChEBI NameLys-Cys-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H26N4O5S
Net Charge0
Average Mass350.441
Monoisotopic Mass350.16239
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(=O)O
InChIInChI=1S/C13H26N4O5S/c1-7(18)10(13(21)22)17-12(20)9(6-23)16-11(19)8(15)4-2-3-5-14/h7-10,18,23H,2-6,14-15H2,1H3,(H,16,19)(H,17,20)(H,21,22)/t7-,8+,9+,10+/m1/s1
InChIKeyXFBBBRDEQIPGNR-KATARQTJSA-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-Cys-Thr (CHEBI:159855) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2R)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-sulanylpropanoyl]amino]-3-hydroxybutanoic acid