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CHEBI:161022 - Met-Pro-His

ChEBI IDCHEBI:161022
ChEBI NameMet-Pro-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H25N5O4S
Net Charge0
Average Mass383.474
Monoisotopic Mass383.16273
SMILESCSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C16H25N5O4S/c1-26-6-4-11(17)15(23)21-5-2-3-13(21)14(22)20-12(16(24)25)7-10-8-18-9-19-10/h8-9,11-13H,2-7,17H2,1H3,(H,18,19)(H,20,22)(H,24,25)/t11-,12-,13-/m0/s1
InChIKeyCAEZLMGDJMEBKP-AVGNSLFASA-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-His (CHEBI:161022) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-1-[(2S)-2-amino-4-methylsulanylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoic acid