[(1S,2S,4S,7R,9S,10S,12R,15S)-4-acetyloxy-15-[(2R,3R)-3-(furan-2-yl)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-propanoyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate | 393101-41-2

• 英文名称: [(1S,2S,4S,7R,9S,10S,12R,15S)-4-acetyloxy-15-[(2R,3R)-3-(furan-2-yl)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]oxy-1,12-dihydroxy-10,14,17,17-tetramethyl-11-oxo-9-propanoyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
• CAS: 393101-41-2
• 化学式: C₄₄H₅₅NO₁₆
• 分子量: 853.9
• InChiKey: XIVMHSNIQAICTR-DMUFGCTNSA-N

物化性质

• 沸点：
  892.5±65.0 °C(Predicted)
• 密度：
  1.37±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  61
• 可旋转键数：
  16
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  244
• 氢给体数：
  4
• 氢受体数：
  16

文献信息

• C7 ESTER AND C10 HYDROXY SUBSTITUTED TAXANES
  申请人：Holton A. Robert

  公开号：US20070249708A1

  公开（公告）日：2007-10-25

  Taxanes having an ester substituent at C(7), a hydroxy substituent at C(10), and a range of C(2), C(9), C(14), and side chain substituents.
• Depletion of cancer stem cells
  申请人：Jewett Anahid

  公开号：US20120009203A1

  公开（公告）日：2012-01-12

  Compositions and methods are provided for killing of cancer stem cells, and for the transplantation of pluripotent stem cells and differentiated cells derived therefrom.
• US7186849B2
  申请人：——

  公开号：US7186849B2

  公开（公告）日：2007-03-06