2-[3-[3,3-Dimethyl-5-oxidoperoxysulfanyl-1-(sulfonatomethyl)indol-2-ylidene]prop-1-enyl]-1,1-dimethyl-3-(sulfonatomethyl)benzo[e]indol-3-ium-7-sulfonate;2-[3-[1,1-dimethyl-9-sulfinatooxy-7-sulfonato-3-(sulfonatomethyl)benzo[e]indol-3-ium-2-yl]prop-2-enylidene]-1,1-dimethyl-7-oxidoperoxysulfanyl-3-(sulfonatomethyl)benzo[e]indole-9-sulfonate

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-[3-[3,3-Dimethyl-5-oxidoperoxysulfanyl-1-(sulfonatomethyl)indol-2-ylidene]prop-1-enyl]-1,1-dimethyl-3-(sulfonatomethyl)benzo[e]indol-3-ium-7-sulfonate;2-[3-[1,1-dimethyl-9-sulfinatooxy-7-sulfonato-3-(sulfonatomethyl)benzo[e]indol-3-ium-2-yl]prop-2-enylidene]-1,1-dimethyl-7-oxidoperoxysulfanyl-3-(sulfonatomethyl)benzo[e]indole-9-sulfonate
• 英文别名: 2-[3-[3,3-dimethyl-5-oxidoperoxysulfanyl-1-(sulfonatomethyl)indol-2-ylidene]prop-1-enyl]-1,1-dimethyl-3-(sulfonatomethyl)benzo[e]indol-3-ium-7-sulfonate;2-[3-[1,1-dimethyl-9-sulfinatooxy-7-sulfonato-3-(sulfonatomethyl)benzo[e]indol-3-ium-2-yl]prop-2-enylidene]-1,1-dimethyl-7-oxidoperoxysulfanyl-3-(sulfonatomethyl)benzo[e]indole-9-sulfonate
• 化学式: C62H54N4O30S10-8
• 分子量: 1655.8
• InChiKey: KRCIVONJYIUPTN-UHFFFAOYSA-F

计算性质

• 辛醇/水分配系数(LogP)：
  4.42
• 重原子数：
  106
• 可旋转键数：
  13
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  674
• 氢给体数：
  0
• 氢受体数：
  35