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CHEBI:161879 - Phe-Thr-Glu

ChEBI IDCHEBI:161879
ChEBI NamePhe-Thr-Glu
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N3O7
Net Charge0
Average Mass395.412
Monoisotopic Mass395.16925
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIInChI=1S/C18H25N3O7/c1-10(22)15(17(26)20-13(18(27)28)7-8-14(23)24)21-16(25)12(19)9-11-5-3-2-4-6-11/h2-6,10,12-13,15,22H,7-9,19H2,1H3,(H,20,26)(H,21,25)(H,23,24)(H,27,28)/t10-,12+,13+,15+/m1/s1
InChIKeyXNQMZHLAYFWSGJ-HTUGSXCWSA-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-Glu (CHEBI:161879) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]pentanedioic acid