EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164646 - Trp-Glu-Glu

Default Structure
ChEBI IDCHEBI:164646
ChEBI NameTrp-Glu-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H26N4O8
Net Charge0
Average Mass462.459
Monoisotopic Mass462.17506
SMILESN[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C21H26N4O8/c22-13(9-11-10-23-14-4-2-1-3-12(11)14)19(30)24-15(5-7-17(26)27)20(31)25-16(21(32)33)6-8-18(28)29/h1-4,10,13,15-16,23H,5-9,22H2,(H,24,30)(H,25,31)(H,26,27)(H,28,29)(H,32,33)/t13-,15-,16-/m0/s1
InChIKeyCZWIHKFGHICAJX-BPUTZDHNSA-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-Glu-Glu (CHEBI:164646) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid
Manual XrefsDatabases
9492141ChemSpider