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CHEBI:164732 - Trp-Ile-Val

Default Structure
ChEBI IDCHEBI:164732
ChEBI NameTrp-Ile-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32N4O4
Net Charge0
Average Mass416.522
Monoisotopic Mass416.24236
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C22H32N4O4/c1-5-13(4)19(21(28)25-18(12(2)3)22(29)30)26-20(27)16(23)10-14-11-24-17-9-7-6-8-15(14)17/h6-9,11-13,16,18-19,24H,5,10,23H2,1-4H3,(H,25,28)(H,26,27)(H,29,30)/t13-,16-,18-,19-/m0/s1
InChIKeyCSRCUZAVBSEDMB-FDARSICLSA-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-Ile-Val (CHEBI:164732) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoic acid