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CHEBI:161032 - Met-Pro-Phe

ChEBI IDCHEBI:161032
ChEBI NameMet-Pro-Phe
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27N3O4S
Net Charge0
Average Mass393.509
Monoisotopic Mass393.17223
SMILESCSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O
InChIInChI=1S/C19H27N3O4S/c1-27-11-9-14(20)18(24)22-10-5-8-16(22)17(23)21-15(19(25)26)12-13-6-3-2-4-7-13/h2-4,6-7,14-16H,5,8-12,20H2,1H3,(H,21,23)(H,25,26)/t14-,15-,16-/m0/s1
InChIKeyMQASRXPTQJJNFM-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)
Met-Pro-Phe (CHEBI:161032) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-1-[(2S)-2-amino-4-methylsulanylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid