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CHEBI:161009 - Met-Pro-Asn

ChEBI IDCHEBI:161009
ChEBI NameMet-Pro-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H24N4O5S
Net Charge0
Average Mass360.436
Monoisotopic Mass360.14674
SMILESCSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O
InChIInChI=1S/C14H24N4O5S/c1-24-6-4-8(15)13(21)18-5-2-3-10(18)12(20)17-9(14(22)23)7-11(16)19/h8-10H,2-7,15H2,1H3,(H2,16,19)(H,17,20)(H,22,23)/t8-,9-,10-/m0/s1
InChIKeyMPCKIRSXNKACRF-GUBZILKMSA-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-Asn (CHEBI:161009) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2S)-1-[(2S)-2-amino-4-methylsulanylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid