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CHEBI:164146 - Thr-Phe-Ile

ChEBI IDCHEBI:164146
ChEBI NameThr-Phe-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H29N3O5
Net Charge0
Average Mass379.457
Monoisotopic Mass379.21072
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O
InChIInChI=1S/C19H29N3O5/c1-4-11(2)16(19(26)27)22-17(24)14(10-13-8-6-5-7-9-13)21-18(25)15(20)12(3)23/h5-9,11-12,14-16,23H,4,10,20H2,1-3H3,(H,21,25)(H,22,24)(H,26,27)/t11-,12+,14-,15-,16-/m0/s1
InChIKeyHSQXHRIRJSFDOH-URLPEUOOSA-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-Ile (CHEBI:164146) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoic acid