[[(2S,5R)-5-(2,6-dichloropurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

• 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: [[(2S,5R)-5-(2,6-dichloropurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
• 化学式: C₁₀H₁₃Cl₂N₄O₁₁P₃
• 分子量: 529.05
• InChiKey: UBMKTEULRNYUBL-NTSWFWBYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.8
• 重原子数：
  30
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  213
• 氢给体数：
  4
• 氢受体数：
  14

文献信息

• NEW PHOSPHODEOXYRIBOSYLTRANSFERASE MUTANT ENZYMES AND USES THEREOF
  申请人：Centre National de la Recherche Scientifique (C.N.R.S.)

  公开号：EP2917341B1

  公开（公告）日：2017-09-27
• [EN] NEW PHOSPHODEOXYRIBOSYLTRANSFERASE MUTANT ENZYMES AND USES THEREOF<br/>[FR] NOUVELLES ENZYMES MUTANTES PHOSPHODÉSOXYRIBOSYLTRANSFÉRASES ET LEURS UTILISATIONS
  申请人：CENTRE NAT RECH SCIENT

  公开号：WO2014072487A1

  公开（公告）日：2014-05-15

  The present invention relates to enzyme mutants obtained from the nucleoside deoxyribosyltransferase (NDT) of Lactobacilli bacteria. These mutants are surprisingly able to exchange deoxyribose mono-, bi- and triphosphate between various nucleobases. In vitro syntheses have been successfully performed with several nucleobase analogs. These enzyme mutants provide new tools to synthesize, in vitro and/or in vivo, dNTPs or analogs thereof.