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CHEBI:164931 - Trp-Val-Val

ChEBI IDCHEBI:164931
ChEBI NameTrp-Val-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30N4O4
Net Charge0
Average Mass402.495
Monoisotopic Mass402.22671
SMILESCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(C)C)C(=O)O
InChIInChI=1S/C21H30N4O4/c1-11(2)17(20(27)25-18(12(3)4)21(28)29)24-19(26)15(22)9-13-10-23-16-8-6-5-7-14(13)16/h5-8,10-12,15,17-18,23H,9,22H2,1-4H3,(H,24,26)(H,25,27)(H,28,29)/t15-,17-,18-/m0/s1
InChIKeyMXKUGFHWYYKVDV-SZMVWBNQSA-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)
Trp-Val-Val (CHEBI:164931) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid