(biotin)3tren | 1229446-88-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 生物素及其衍生物
• 英文名称: (biotin)3tren
• 英文别名: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[bis[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethyl]amino]ethyl]pentanamide
• CAS: 1229446-88-1
• 化学式: C₃₆H₆₀N₁₀O₆S₃
• 分子量: 825.134
• InChiKey: WDWCHKFUQNXBHR-VZYSTDRKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.2
• 重原子数：
  55
• 可旋转键数：
  24
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  290
• 氢给体数：
  9
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  三(2-氨基乙基)胺 、 (+)-生物素 4-硝基苯酯 以 N,N-二甲基甲酰胺 为溶剂， 以49%的产率得到(biotin)3tren
  参考文献：
  名称：

  Self-Assembled Morphologies from C₂- and C₃-Symmetric Biotin Conjugates

  摘要：

  Synthesis and characterization of C-2- and C-3-symmetric D-biotin conjugates has been realized, followed by the investigation of solution state self-assembly behavior of these conjugates by various microscopy techniques. Interestingly, the C-2-symmetric conjugate affords the formation of fibrous structures, while the C-3-symmetric conjugate reveals the formation of marigold flower-like spherical morphologies.

  DOI：

  10.1021/jo100881r

文献信息

• Self-Assembled Morphologies from <i>C</i>₂- and <i>C</i>₃-Symmetric Biotin Conjugates
  作者：K. B. Joshi、K. Vijaya Krishna、Sandeep Verma

  DOI：10.1021/jo100881r

  日期：2010.6.18

  Synthesis and characterization of C-2- and C-3-symmetric D-biotin conjugates has been realized, followed by the investigation of solution state self-assembly behavior of these conjugates by various microscopy techniques. Interestingly, the C-2-symmetric conjugate affords the formation of fibrous structures, while the C-3-symmetric conjugate reveals the formation of marigold flower-like spherical morphologies.