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CHEBI:162769 - Pro-Tyr-Thr

ChEBI IDCHEBI:162769
ChEBI NamePro-Tyr-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N3O6
Net Charge0
Average Mass379.413
Monoisotopic Mass379.17434
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C18H25N3O6/c1-10(22)15(18(26)27)21-17(25)14(9-11-4-6-12(23)7-5-11)20-16(24)13-3-2-8-19-13/h4-7,10,13-15,19,22-23H,2-3,8-9H2,1H3,(H,20,24)(H,21,25)(H,26,27)/t10-,13+,14+,15+/m1/s1
InChIKeyQKWYXRPICJEQAJ-KJEVXHAQSA-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)
Pro-Tyr-Thr (CHEBI:162769) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-3-hydroxy-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]butanoic acid