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CHEBI:166399 - Val-Trp-Glu

ChEBI IDCHEBI:166399
ChEBI NameVal-Trp-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28N4O6
Net Charge0
Average Mass432.477
Monoisotopic Mass432.20088
SMILESCC(C)[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C21H28N4O6/c1-11(2)18(22)20(29)25-16(9-12-10-23-14-6-4-3-5-13(12)14)19(28)24-15(21(30)31)7-8-17(26)27/h3-6,10-11,15-16,18,23H,7-9,22H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t15-,16-,18-/m0/s1
InChIKeyUFCHCOKFAGOQSF-BQFCYCMXSA-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)
Val-Trp-Glu (CHEBI:166399) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]pentanedioic acid