EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:160366 - Lys-Trp-Thr

ChEBI IDCHEBI:160366
ChEBI NameLys-Trp-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H31N5O5
Net Charge0
Average Mass433.509
Monoisotopic Mass433.23252
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CCCCN)C(=O)O
InChIInChI=1S/C21H31N5O5/c1-12(27)18(21(30)31)26-20(29)17(25-19(28)15(23)7-4-5-9-22)10-13-11-24-16-8-3-2-6-14(13)16/h2-3,6,8,11-12,15,17-18,24,27H,4-5,7,9-10,22-23H2,1H3,(H,25,28)(H,26,29)(H,30,31)/t12-,15+,17+,18+/m1/s1
InChIKeyBIWVMACFGZFIEB-VFAJRCTISA-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-Trp-Thr (CHEBI:160366) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxybutanoic acid