EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164779 - Trp-Met-Glu

ChEBI IDCHEBI:164779
ChEBI NameTrp-Met-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28N4O6S
Net Charge0
Average Mass464.544
Monoisotopic Mass464.17296
SMILESCSCC[C@H](NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C21H28N4O6S/c1-32-9-8-16(20(29)25-17(21(30)31)6-7-18(26)27)24-19(28)14(22)10-12-11-23-15-5-3-2-4-13(12)15/h2-5,11,14,16-17,23H,6-10,22H2,1H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t14-,16-,17-/m0/s1
InChIKeyTUUXFNQXSFNFLX-XIRDDKMYSA-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)
Trp-Met-Glu (CHEBI:164779) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulanylbutanoyl]amino]pentanedioic acid