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CHEBI:163301 - Glu-Trp-Gln

ChEBI IDCHEBI:163301
ChEBI NameGlu-Trp-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H27N5O7
Net Charge0
Average Mass461.475
Monoisotopic Mass461.19105
SMILESNC(=O)CC[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
InChIInChI=1S/C21H27N5O7/c22-13(5-8-18(28)29)19(30)26-16(9-11-10-24-14-4-2-1-3-12(11)14)20(31)25-15(21(32)33)6-7-17(23)27/h1-4,10,13,15-16,24H,5-9,22H2,(H2,23,27)(H,25,31)(H,26,30)(H,28,29)(H,32,33)/t13-,15-,16-/m0/s1
InChIKeyZNOHKCPYDAYYDA-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)
Glu-Trp-Gln (CHEBI:163301) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-1-[[(1S)-4-amino-1-carboxy-4-oxobutyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid