| 195142-08-6

• CAS: 195142-08-6
• 化学式: C₃₈H₅₄O₁₁Si
• 分子量: 714.926
• InChiKey: MURFFFRGGFNOAV-AHQDNHDTSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.07
• 重原子数：
  50.0
• 可旋转键数：
  10.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  154.89
• 氢给体数：
  2.0
• 氢受体数：
  11.0

反应信息

• 作为反应物：
  描述：

  (3R,4S)-3-(tert-Butyl-dimethyl-silanyloxy)-2-oxo-4-phenyl-azetidine-1-carboxylic acid tert-butyl ester 、 在 氢氟酸 、 sodium hexamethyldisilazane 作用下， 生成 [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-14-ethyl-1,9-dihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,17,17-trimethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
  参考文献：
  名称：

  First synthesis and cytotoxic activity of novel docetaxel analogs modified at the C18-position

  摘要：

  To investigate the effect of the C-18 position of docetaxel in its cytotoxic activity, 18-modified docetaxel analogs were synthesized for the first time from the 18-brominated baccatin derivatives. All of these analogs were found to be less active than docetaxel in cytotoxic activity against four test cell lines. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)10128-7
• 作为产物：
  描述：

  在 咪唑 、 氢氟酸 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  First synthesis and cytotoxic activity of novel docetaxel analogs modified at the C18-position

  摘要：

  To investigate the effect of the C-18 position of docetaxel in its cytotoxic activity, 18-modified docetaxel analogs were synthesized for the first time from the 18-brominated baccatin derivatives. All of these analogs were found to be less active than docetaxel in cytotoxic activity against four test cell lines. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)10128-7