EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:162803 - Pro-Val-Phe

ChEBI IDCHEBI:162803
ChEBI NamePro-Val-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27N3O4
Net Charge0
Average Mass361.442
Monoisotopic Mass361.20016
SMILESCC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C19H27N3O4/c1-12(2)16(22-17(23)14-9-6-10-20-14)18(24)21-15(19(25)26)11-13-7-4-3-5-8-13/h3-5,7-8,12,14-16,20H,6,9-11H2,1-2H3,(H,21,24)(H,22,23)(H,25,26)/t14-,15-,16-/m0/s1
InChIKeyVDHGTOHMHHQSKG-JYJNAYRXSA-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-Val-Phe (CHEBI:162803) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-3-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]-3-phenylpropanoic acid
Manual XrefsDatabases
57485826ChemSpider