2-[5-(1,1-Dimethyl-3-propyl-5,8-disulfobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-1,1-dimethyl-3-[6-oxo-6-[2-[[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoylamino]ethylamino]hexyl]benzo[e]indole-5,8-disulfonic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-[5-(1,1-Dimethyl-3-propyl-5,8-disulfobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-1,1-dimethyl-3-[6-oxo-6-[2-[[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoylamino]ethylamino]hexyl]benzo[e]indole-5,8-disulfonic acid
• 英文别名: 2-[5-(1,1-dimethyl-3-propyl-5,8-disulfobenzo[e]indol-3-ium-2-yl)penta-2,4-dienylidene]-1,1-dimethyl-3-[6-oxo-6-[2-[[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]carbamoylamino]ethylamino]hexyl]benzo[e]indole-5,8-disulfonic acid
• 化学式: C51H64N5O19S4+
• 分子量: 1179.3
• InChiKey: WRQXQOXEKYKVNS-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  79
• 可旋转键数：
  20
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  418
• 氢给体数：
  11
• 氢受体数：
  20

文献信息

• Molecular probes for imaging of myelin
  申请人：Case Western Reserve University

  公开号：EP2910945A1

  公开（公告）日：2015-08-26

  A molecular probe for labeling myelin includes a fluorescent trans-stilbene derivative.

  用于标记髓鞘的分子探针包括一种荧光反式二苯乙烯衍生物。
• [EN] MOLECULAR PROBES FOR DETECTING LIPIDS<br/>[FR] SONDES MOLÉCULAIRES POUR LA DÉTECTION DE LIPIDES
  申请人：UNIV CASE WESTERN RESERVE

  公开号：WO2013126898A1

  公开（公告）日：2013-08-29

  A method of detecting aberrant lipid accumulation in a subject includes administering to the subject a molecular probe that includes a fluorescent trans stilbene derivative or stilbenzene derivative and detecting the amount or distribution of the molecular probe in a tissue of interest of the subject.