cis-5'-O-[4-(3-acetylphenyl)-2-oxo-1,3-dioxaphosposphorin-2-yl]-2'-C-methyladenosine | 926654-13-9

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘌呤核苷酸
• 英文名称: cis-5'-O-[4-(3-acetylphenyl)-2-oxo-1,3-dioxaphosposphorin-2-yl]-2'-C-methyladenosine
• 英文别名: 1-[3-[2-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy]-2-oxo-1,3,2lambda5-dioxaphosphinan-4-yl]phenyl]ethanone；1-[3-[2-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-4-methyloxolan-2-yl]methoxy]-2-oxo-1,3,2λ5-dioxaphosphinan-4-yl]phenyl]ethanone
• CAS: 926654-13-9
• 化学式: C₂₂H₂₆N₅O₈P
• 分子量: 519.451
• InChiKey: RIAHURXNIWLNJX-LLXNRSKXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1
• 重原子数：
  36
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  181
• 氢给体数：
  3
• 氢受体数：
  12

文献信息

• Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives
  申请人：Erion Mark D.

  公开号：US20090118223A1

  公开（公告）日：2009-05-07

  Novel 2′-C-methyl nucleoside 5′-monophosphate and 4′-C-methyl nucleoside 5′-monophosphate derivatives, stereoisomers, and pharmaceutically acceptable salts or prodrugs thereof, their preparation, and their uses for the treatment of hepatitis C viral infection are described.