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CHEBI:161959 - Phe-Tyr-Ile

ChEBI IDCHEBI:161959
ChEBI NamePhe-Tyr-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H31N3O5
Net Charge0
Average Mass441.528
Monoisotopic Mass441.22637
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C24H31N3O5/c1-3-15(2)21(24(31)32)27-23(30)20(14-17-9-11-18(28)12-10-17)26-22(29)19(25)13-16-7-5-4-6-8-16/h4-12,15,19-21,28H,3,13-14,25H2,1-2H3,(H,26,29)(H,27,30)(H,31,32)/t15-,19-,20-,21-/m0/s1
InChIKeyMMPBPRXOFJNCCN-ZEWNOJEFSA-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-Tyr-Ile (CHEBI:161959) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoic acid