117654-61-2

Basic information

• Product Name: 9-(3'-C-methyl-5'-O-(triphenylmethyl)-2'-deoxy-β-D-xylofuranosyl)adenine
• CAS NO: 117654-61-2
• Molecular Weight: 507.592
• Mol File: 117654-61-2.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 9-(3'-C-methyl-5'-O-(triphenylmethyl)-2'-deoxy-β-D-xylofuranosyl)adenine(CAS DataBase Reference)
• NIST Chemistry Reference: 9-(3'-C-methyl-5'-O-(triphenylmethyl)-2'-deoxy-β-D-xylofuranosyl)adenine(117654-61-2)
• EPA Substance Registry System: 9-(3'-C-methyl-5'-O-(triphenylmethyl)-2'-deoxy-β-D-xylofuranosyl)adenine(117654-61-2)

Safety Data

• Hazardous Substances Data: 117654-61-2(Hazardous Substances Data)

Upstream product

• 917-64-6 methyl magnesium iodide 
• 87412-04-2 2'-O-(p-toluenesulfonyl)-5'-O-(triphenylmethyl)adenosine 
• 76-83-5 trityl chloride 
• 42776-78-3 2'-O-tosyladenosine 

Relevant articles and documents

Synthesis and conformation of 1-(3'-C-methyl-2'-deoxy-β-D-xylofuranosyl)uracil and 9-(3'-C'-methyl-2'-deoxy-β-D-xylofuranosyl)adenine; two novel sugar-methylated nucleoside analogues

The preparation and high-resolution 1H NMR conformational analysis of the two novel nucleoside analogues, 1-(3'-C-methyl-2'-deoxy-β-D-xylofuranosyl)uracil (compound 1) and 9-(3'-C-methyl-2'-deoxy-β-D-xylofuranosyl)adenine (compound 2), are described.Compounds 1 and 2show a pronounced preference for the north conformation of the sugar ring.The north conformation corresponds with a sterically favoured equatorial location of the methyl group.The C4'-C5' conformation in 1 and 2 is predominantly γt (trans orientation of O5' and C3').The configuration at C3' in 1 and 2 was corroborated via a one-dimensional NOE experiment.The structure of compound 1 (originally assigned as having the C3'-methyl group on the β-face of the furanosyl moiety) is revised on the basis of these data.