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CHEBI:160895 - Met-Lys-Gln

ChEBI IDCHEBI:160895
ChEBI NameMet-Lys-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H31N5O5S
Net Charge0
Average Mass405.521
Monoisotopic Mass405.20459
SMILESCSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C16H31N5O5S/c1-27-9-7-10(18)14(23)20-11(4-2-3-8-17)15(24)21-12(16(25)26)5-6-13(19)22/h10-12H,2-9,17-18H2,1H3,(H2,19,22)(H,20,23)(H,21,24)(H,25,26)/t10-,11-,12-/m0/s1
InChIKeyMSSJHBAKDDIRMJ-SRVKXCTJSA-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-Lys-Gln (CHEBI:160895) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]hexanoyl]amino]-5-oxopentanoic acid