(3aS,4S,6S,6aR)-6-Methoxy-2,2-dimethyl-4-phenyl-tetrahydro-furo[3,4-d][1,3]dioxole-4-carboxylic acid methyl ester | 1053697-31-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (3aS,4S,6S,6aR)-6-Methoxy-2,2-dimethyl-4-phenyl-tetrahydro-furo[3,4-d][1,3]dioxole-4-carboxylic acid methyl ester
• 英文别名: methyl (3aS,4S,6S,6aR)-6-methoxy-2,2-dimethyl-4-phenyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxole-4-carboxylate
• CAS: 1053697-31-6
• 化学式: C₁₆H₂₀O₆
• 分子量: 308.331
• InChiKey: KXJXQSGKDFXZMO-DVZHBHJUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  63.2
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  (3aS,4S,6S,6aR)-6-Methoxy-2,2-dimethyl-4-phenyl-tetrahydro-furo[3,4-d][1,3]dioxole-4-carboxylic acid methyl ester 在 锂硼氢 作用下， 生成 ((3aS,4R,6S,6aR)-6-Methoxy-2,2-dimethyl-4-phenyl-tetrahydro-furo[3,4-d][1,3]dioxol-4-yl)-methanol
  参考文献：
  名称：

  Chemoenzymic Synthesis of 4-Substituted Riboses. S-(4'-Methyladenosyl)-L-homocysteine

  摘要：

  The synthesis of 4-C-methyl-D-ribose, 4-C-methyl-D-ribose, D-ribose-4-d, and L-ribose derivatives as well as the title nucleoside by a chemoenzymatic strategy beginning from cyclopentadiene is described.

  DOI：

  10.1021/jo00099a005
• 作为产物：
  描述：

  (3αS,4R,6S,6αR)-4β-acetoxy-2,2-dimethyl-6-hydroxy-3aβ,5,6α,6aβ-tetrahydro-4H-cyclopenta-1,3-dioxole 在 吡啶 、 重铬酸吡啶 、 二甲基硫 、 4 A molecular sieve 、 溴 、 对甲苯磺酸 、 臭氧 作用下， 以 乙醚 、 二氯甲烷 、 丙酮 为溶剂， 生成 (3aS,4S,6S,6aR)-6-Methoxy-2,2-dimethyl-4-phenyl-tetrahydro-furo[3,4-d][1,3]dioxole-4-carboxylic acid methyl ester
  参考文献：
  名称：

  Chemoenzymic Synthesis of 4-Substituted Riboses. S-(4'-Methyladenosyl)-L-homocysteine

  摘要：

  The synthesis of 4-C-methyl-D-ribose, 4-C-methyl-D-ribose, D-ribose-4-d, and L-ribose derivatives as well as the title nucleoside by a chemoenzymatic strategy beginning from cyclopentadiene is described.

  DOI：

  10.1021/jo00099a005

文献信息

• Chemoenzymic Synthesis of 4-Substituted Riboses. S-(4'-Methyladenosyl)-L-homocysteine
  作者：Carl R. Johnson、John L. Esker、Michael C. Van Zandt

  DOI：10.1021/jo00099a005

  日期：1994.10

  The synthesis of 4-C-methyl-D-ribose, 4-C-methyl-D-ribose, D-ribose-4-d, and L-ribose derivatives as well as the title nucleoside by a chemoenzymatic strategy beginning from cyclopentadiene is described.