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CHEBI:161893 - Phe-Thr-Phe

ChEBI IDCHEBI:161893
ChEBI NamePhe-Thr-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H27N3O5
Net Charge0
Average Mass413.474
Monoisotopic Mass413.19507
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C22H27N3O5/c1-14(26)19(25-20(27)17(23)12-15-8-4-2-5-9-15)21(28)24-18(22(29)30)13-16-10-6-3-7-11-16/h2-11,14,17-19,26H,12-13,23H2,1H3,(H,24,28)(H,25,27)(H,29,30)/t14-,17+,18+,19+/m1/s1
InChIKeyBPIMVBKDLSBKIJ-FCLVOEFKSA-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-Thr-Phe (CHEBI:161893) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoic acid