134785-39-0

Basic information

• Product Name: (S)-ethyl 1,6,11-tritosyl-1,6,11-triazacyclohexadecane-12-carboxylate
• CAS NO: 134785-39-0
• Molecular Weight: 762.025
• Mol File: 134785-39-0.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: (S)-ethyl 1,6,11-tritosyl-1,6,11-triazacyclohexadecane-12-carboxylate(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-ethyl 1,6,11-tritosyl-1,6,11-triazacyclohexadecane-12-carboxylate(134785-39-0)
• EPA Substance Registry System: (S)-ethyl 1,6,11-tritosyl-1,6,11-triazacyclohexadecane-12-carboxylate(134785-39-0)

Safety Data

• Hazardous Substances Data: 134785-39-0(Hazardous Substances Data)

Upstream product

• 98-59-9 p-toluenesulfonyl chloride 
• 51866-92-3 2,6-bis(tosylamino)hexanoic acid 
• 121712-12-7 N,N'-bis(4-hydroxybutyl)toluene-p-sulphonamide 
• 657-27-2 L-Lysine hydrochloride 
• 121712-13-8 4,4'-toluene-p-sulphonyliminodibutyl bismethanesulphonate 
• 134785-37-8 ethyl 2,6-bis(tosylamino)hexanoate 
• 121712-11-6 4-Methyl-N,N-bis-[4-(tetrahydro-pyran-2-yloxy)-butyl]-benzenesulfonamide 

Relevant articles and documents

Macrocyclic Polyamines -N3 and -N4: Synthesis and Study of their ATP Complexation by 31P Nuclear Magnetic Resonance Spectroscopy

The macrocyclic polyamines -N3, compound 1, and -N4, compound 2, possessing a hydroxymethyl side-chain have been synthesized.The macrocyclisation was achieved by condensation of lysine ditosate 3b with appropriate components 5 and 6 in the presence of CsCO3 to obtain 7 and 8 in 33 and 37percent yield, respectively.The complexation of polyamines 1 and 2 with ATP was studied by 31P NMR spectroscopy, which indicated a specific recognition of γ-phosphorus of ATP (NMe4 salt) by the polyamines.The binding constant estimates indicated that ATP binds compound 2 ca. 35-times stronger than it does compound 1.The binding curves indicated a definite 1:1 stoicheiometry for 2:ATP complex, and not so well defined stoicheiometry for 1:ATP binding.The mononucleotides, AMP and cAMP, and dinucleotide TpT did not show significant complexation with either compound 1 or 2.The binding of ATP by macrocyclic polyamines 1 and 2 and the presence of a hydroxymethyl side-chain to link with a nucleophile may aid rational design of chemical nucleases.