[(3S,4S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-8-[(4R,6R)-6-[[(4S,6R)-6-[[(4R,6S)-6-[[(2S,4R,6S)-4-[tert-butyl(dimethyl)silyl]oxy-6-(2-oxoethyl)oxan-2-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]-2,4-dimethyloctan-3-yl] 2-diethoxyphosphorylpropanoate | 189195-82-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机膦酸及其衍生物
• 英文名称: [(3S,4S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-8-[(4R,6R)-6-[[(4S,6R)-6-[[(4R,6S)-6-[[(2S,4R,6S)-4-[tert-butyl(dimethyl)silyl]oxy-6-(2-oxoethyl)oxan-2-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]-2,4-dimethyloctan-3-yl] 2-diethoxyphosphorylpropanoate
• CAS: 189195-82-2
• 化学式: C₅₇H₁₀₉O₁₅PSi₂
• 分子量: 1121.63
• InChiKey: WWAOAGNSHUARRE-PBSRVVICSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.83
• 重原子数：
  75
• 可旋转键数：
  29
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.96
• 拓扑面积：
  162
• 氢给体数：
  0
• 氢受体数：
  15

反应信息

• 作为反应物：
  描述：

  [(3S,4S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-8-[(4R,6R)-6-[[(4S,6R)-6-[[(4R,6S)-6-[[(2S,4R,6S)-4-[tert-butyl(dimethyl)silyl]oxy-6-(2-oxoethyl)oxan-2-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]-2,4-dimethyloctan-3-yl] 2-diethoxyphosphorylpropanoate 生成 (1S,3S,7R,9R,13S,15R,19R,21S,24S,25S,28E,30E,32E,34E,36E,39R,41S)-21,41-bis[[tert-butyl(dimethyl)silyl]oxy]-5,5,11,11,17,17,24,28-octamethyl-25-propan-2-yl-4,6,10,12,16,18,26,43-octaoxapentacyclo[37.3.1.13,7.19,13.115,19]hexatetraconta-28,30,32,34,36-pentaen-27-one
  参考文献：
  名称：

  Prins Desymmetrization of a C₂-Symmetric Diol:  Application to the Synthesis of 17-Deoxyroflamycoin

  摘要：

  DOI：

  10.1021/jo970380f
• 作为产物：
  描述：

  [(2R,4S,6S)-2-(2-Benzyloxy-ethyl)-6-((4S,6R)-6-bromomethyl-2,2-dimethyl-[1,3]dioxan-4-ylmethyl)-tetrahydro-pyran-4-yloxy]-tert-butyl-dimethyl-silane 在 咪唑 、 N,N-二甲基丙烯基脲 、 lithium diethylamide 、 四丁基氟化铵 、 氨 、 碘 、 lithium 、 三苯基膦 作用下， 生成 [(3S,4S,7S)-7-[tert-butyl(dimethyl)silyl]oxy-8-[(4R,6R)-6-[[(4S,6R)-6-[[(4R,6S)-6-[[(2S,4R,6S)-4-[tert-butyl(dimethyl)silyl]oxy-6-(2-oxoethyl)oxan-2-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]methyl]-2,2-dimethyl-1,3-dioxan-4-yl]-2,4-dimethyloctan-3-yl] 2-diethoxyphosphorylpropanoate
  参考文献：
  名称：

  Prins Desymmetrization of a C₂-Symmetric Diol:  Application to the Synthesis of 17-Deoxyroflamycoin

  摘要：

  DOI：

  10.1021/jo970380f

文献信息

• Prins Desymmetrization of a <i>C</i>₂-Symmetric Diol:  Application to the Synthesis of 17-Deoxyroflamycoin
  作者：Scott D. Rychnovsky、Guang Yang、Yueqing Hu、Uday R. Khire

  DOI：10.1021/jo970380f

  日期：1997.5.1