3-[2-[(4,7-Dihydroxynaphthalen-1-yl)methyl]-2,3,4,5,6-pentahydroxyhexyl]peroxy-10-(4-ethyl-4,5-dihydropyrrolo[2,3-c]pyrrol-5-ium-5-yl)-8-methylspiro[3,4-dihydropyrano[3,2-g]chromene-2,8'-3-azatetracyclo[12.4.0.01,5.06,11]octadec-10-ene]-2',6-dione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: 3-[2-[(4,7-Dihydroxynaphthalen-1-yl)methyl]-2,3,4,5,6-pentahydroxyhexyl]peroxy-10-(4-ethyl-4,5-dihydropyrrolo[2,3-c]pyrrol-5-ium-5-yl)-8-methylspiro[3,4-dihydropyrano[3,2-g]chromene-2,8'-3-azatetracyclo[12.4.0.01,5.06,11]octadec-10-ene]-2',6-dione
• 英文别名: 3-[2-[(4,7-dihydroxynaphthalen-1-yl)methyl]-2,3,4,5,6-pentahydroxyhexyl]peroxy-10-(4-ethyl-4,5-dihydropyrrolo[2,3-c]pyrrol-5-ium-5-yl)-8-methylspiro[3,4-dihydropyrano[3,2-g]chromene-2,8'-3-azatetracyclo[12.4.0.01,5.06,11]octadec-10-ene]-2',6-dione
• 化学式: C54H62N3O13+
• 分子量: 961.1
• InChiKey: NHNCWNOXKAHGHB-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  70
• 可旋转键数：
  12
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  242
• 氢给体数：
  9
• 氢受体数：
  14