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CHEBI:158954 - Arg-Glu-Trp

Default Structure
ChEBI IDCHEBI:158954
ChEBI NameArg-Glu-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H31N7O6
Net Charge0
Average Mass489.533
Monoisotopic Mass489.23358
SMILESNC(N)=NCCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C22H31N7O6/c23-14(5-3-9-26-22(24)25)19(32)28-16(7-8-18(30)31)20(33)29-17(21(34)35)10-12-11-27-15-6-2-1-4-13(12)15/h1-2,4,6,11,14,16-17,27H,3,5,7-10,23H2,(H,28,32)(H,29,33)(H,30,31)(H,34,35)(H4,24,25,26)/t14-,16-,17-/m0/s1
InChIKeyJQFJNGVSGOUQDH-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)
Arg-Glu-Trp (CHEBI:158954) is a tripeptide (CHEBI:47923)
IUPAC Name 
(4S)-4-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-5-oxopentanoic acid
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