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CHEBI:164162 - Thr-Phe-Trp

Default Structure
ChEBI IDCHEBI:164162
ChEBI NameThr-Phe-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H28N4O5
Net Charge0
Average Mass452.511
Monoisotopic Mass452.20597
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C24H28N4O5/c1-14(29)21(25)23(31)27-19(11-15-7-3-2-4-8-15)22(30)28-20(24(32)33)12-16-13-26-18-10-6-5-9-17(16)18/h2-10,13-14,19-21,26,29H,11-12,25H2,1H3,(H,27,31)(H,28,30)(H,32,33)/t14-,19+,20+,21+/m1/s1
InChIKeyXIHGJKFSIDTDKV-LYARXQMPSA-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)
Thr-Phe-Trp (CHEBI:164162) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoic acid