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CHEBI:45847 - p-Ts-L-Lys-Me

ChEBI IDCHEBI:45847
ChEBI Namep-Ts-L-Lys-Me
Stars
ASCII Namep-Ts-L-Lys-Me
DefinitionA methyl ketone that is L-lysine with an α-amine hydrogen substituted with a 4-methylbenzenesulfonamide (tosyl) group and a methyl group replacing the hydroxy of the carboxylic acid.
Last Modified14 March 2013
DownloadsMolfile
FormulaC14H22N2O3S
Net Charge0
Average Mass298.408
Monoisotopic Mass298.13511
SMILESCC(=O)[C@H](CCCCN)NS(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C14H22N2O3S/c1-11-6-8-13(9-7-11)20(18,19)16-14(12(2)17)5-3-4-10-15/h6-9,14,16H,3-5,10,15H2,1-2H3/t14-/m0/s1
InChIKeyKARUWQQASOADOA-AWEZNQCLSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
p-Ts-L-Lys-Me (CHEBI:45847) has functional parent L-lysine (CHEBI:18019)
p-Ts-L-Lys-Me (CHEBI:45847) has role metabolite (CHEBI:25212)
p-Ts-L-Lys-Me (CHEBI:45847) is a methyl ketone (CHEBI:51867)
p-Ts-L-Lys-Me (CHEBI:45847) is a primary amine (CHEBI:32877)
p-Ts-L-Lys-Me (CHEBI:45847) is a sulfonamide (CHEBI:35358)
IUPAC Name 
N-[(3S)-7-amino-2-oxoheptan-3-yl]-4-methylbenzenesulfonamide
Synonym  Source
N-tosyl-L-lysinyl methyl ketoneChEBI
Citations