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CHEBI:163293 - Glu-Trp-Arg

ChEBI IDCHEBI:163293
ChEBI NameGlu-Trp-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H31N7O6
Net Charge0
Average Mass489.533
Monoisotopic Mass489.23358
SMILESNC(N)=NCCC[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
InChIInChI=1S/C22H31N7O6/c23-14(7-8-18(30)31)19(32)29-17(10-12-11-27-15-5-2-1-4-13(12)15)20(33)28-16(21(34)35)6-3-9-26-22(24)25/h1-2,4-5,11,14,16-17,27H,3,6-10,23H2,(H,28,33)(H,29,32)(H,30,31)(H,34,35)(H4,24,25,26)/t14-,16-,17-/m0/s1
InChIKeyJDAYMLXPUJRSDJ-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)
Glu-Trp-Arg (CHEBI:163293) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-amino-5-[[(2S)-1-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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