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CHEBI:161941 - Phe-Trp-Val

ChEBI IDCHEBI:161941
ChEBI NamePhe-Trp-Val
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Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H30N4O4
Net Charge0
Average Mass450.539
Monoisotopic Mass450.22671
SMILESCC(C)[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C25H30N4O4/c1-15(2)22(25(32)33)29-24(31)21(13-17-14-27-20-11-7-6-10-18(17)20)28-23(30)19(26)12-16-8-4-3-5-9-16/h3-11,14-15,19,21-22,27H,12-13,26H2,1-2H3,(H,28,30)(H,29,31)(H,32,33)/t19-,21-,22-/m0/s1
InChIKeyBTAIJUBAGLVFKQ-BVSLBCMMSA-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)
Phe-Trp-Val (CHEBI:161941) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methylbutanoic acid
Manual XrefsDatabases
9879803ChemSpider