11-(Oxan-2-yloxy)undeca-2,9-diyn-1-ol | 204523-69-3

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 11-(Oxan-2-yloxy)undeca-2,9-diyn-1-ol
• 英文别名: 11-(oxan-2-yloxy)undeca-2,9-diyn-1-ol
• CAS: 204523-69-3
• 化学式: C₁₆H₂₄O₃
• 分子量: 264.365
• InChiKey: DWLYVUYPIHSOGH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  11-(Oxan-2-yloxy)undeca-2,9-diyn-1-ol 在 4-甲基苯磺酸吡啶 、 三乙胺 作用下， 以 甲醇 为溶剂， 生成 11-phenylsulfanylundeca-2,9-diyn-1-ol
  参考文献：
  名称：

  Remarkable tethering effect on DNA cleavage of propargylic sulfone conjugates with intercalating moieties

  摘要：

  A number of novel propargylic sulfone conjugates 3 and 4 with intercalating moieties were synthesized and evaluated for DNA cleavage activity through nucleic base alkylation. A remarkable enhancement in DNA cleaving potency was observed with those conjugates 3 possessing a suitable spacer, a right attachment point at the aromatic ring, and a good intercalator.

  DOI：

  10.1016/s0960-894x(97)10203-7
• 作为产物：
  描述：

  (3-tetrahydropyran-2-yloxy-prop-1-ynyl)-lithium 在 4-甲基苯磺酸吡啶 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 26.5h， 生成 11-(Oxan-2-yloxy)undeca-2,9-diyn-1-ol
  参考文献：
  名称：

  Remarkable tethering effect on DNA cleavage of propargylic sulfone conjugates with intercalating moieties

  摘要：

  A number of novel propargylic sulfone conjugates 3 and 4 with intercalating moieties were synthesized and evaluated for DNA cleavage activity through nucleic base alkylation. A remarkable enhancement in DNA cleaving potency was observed with those conjugates 3 possessing a suitable spacer, a right attachment point at the aromatic ring, and a good intercalator.

  DOI：

  10.1016/s0960-894x(97)10203-7

文献信息

• Bifunctional 2-naphthyl propargylic sulfones exhibiting high DNA intercalating and alkylating activity
  作者：Wei-Min Dai、Chun Wo Chow、Ling Zhou、Atsushi Ishii、Chi Wai Lau、Quan Li、Wataru Hamaguchi、Sei-ichi Nishimoto

  DOI：10.1016/s0960-894x(99)00475-8

  日期：1999.10

  number of novel 2-naphthyl propargylic sulfones were synthesized as nucleic base alkylating agents. Extremely high DNA cleavage activity was observed for the sulfones with a free omega-hydroxyl group in the carbon chain in contrast to the ester conjugates possessing an additional intercalating unit.

  合成了许多新颖的2-萘基炔丙基砜作为核酸碱基烷基化剂。与具有额外插入单元的酯缀合物相反，对于在碳链中具有游离ω-羟基的砜，观察到极高的DNA裂解活性。