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CHEBI:163325 - Glu-Trp-Trp

ChEBI IDCHEBI:163325
ChEBI NameGlu-Trp-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H29N5O6
Net Charge0
Average Mass519.558
Monoisotopic Mass519.21178
SMILESN[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C27H29N5O6/c28-19(9-10-24(33)34)25(35)31-22(11-15-13-29-20-7-3-1-5-17(15)20)26(36)32-23(27(37)38)12-16-14-30-21-8-4-2-6-18(16)21/h1-8,13-14,19,22-23,29-30H,9-12,28H2,(H,31,35)(H,32,36)(H,33,34)(H,37,38)/t19-,22-,23-/m0/s1
InChIKeyXAXJIUAWAFVADB-VJBMBRPKSA-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)
Glu-Trp-Trp (CHEBI:163325) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid