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CHEBI:162045 - Pro-Ala-Phe

Default Structure
ChEBI IDCHEBI:162045
ChEBI NamePro-Ala-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H23N3O4
Net Charge0
Average Mass333.388
Monoisotopic Mass333.16886
SMILESC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C17H23N3O4/c1-11(19-16(22)13-8-5-9-18-13)15(21)20-14(17(23)24)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14,18H,5,8-10H2,1H3,(H,19,22)(H,20,21)(H,23,24)/t11-,13-,14-/m0/s1
InChIKeyCQZNGNCAIXMAIQ-UBHSHLNASA-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-Ala-Phe (CHEBI:162045) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-3-phenyl-2-[[(2S)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoic acid