36-[1-(4,7-Dihydroxynaphthalen-1-yl)-2,3,4,5,6-pentahydroxyhexan-2-yl]-11-ethyl-6-methyl-32-(methylamino)-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.320,29.216,19.110,13.112,15.119,23.03,8.09,43.023,27.028,40.031,41.033,39.041,45]pentapentaconta-1,3(8),5,9(43),11,13(55),15(54),17,29,33(39),34-undecaen-48-yne-4,24-dione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 36-[1-(4,7-Dihydroxynaphthalen-1-yl)-2,3,4,5,6-pentahydroxyhexan-2-yl]-11-ethyl-6-methyl-32-(methylamino)-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.320,29.216,19.110,13.112,15.119,23.03,8.09,43.023,27.028,40.031,41.033,39.041,45]pentapentaconta-1,3(8),5,9(43),11,13(55),15(54),17,29,33(39),34-undecaen-48-yne-4,24-dione
• 英文别名: 36-[1-(4,7-dihydroxynaphthalen-1-yl)-2,3,4,5,6-pentahydroxyhexan-2-yl]-11-ethyl-6-methyl-32-(methylamino)-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.320,29.216,19.110,13.112,15.119,23.03,8.09,43.023,27.028,40.031,41.033,39.041,45]pentapentaconta-1,3(8),5,9(43),11,13(55),15(54),17,29,33(39),34-undecaen-48-yne-4,24-dione
• 化学式: C₆₈H₇₀N₄O₁₃
• 分子量: 1151.3
• InChiKey: PDIULGIYLQOCMA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  85
• 可旋转键数：
  9
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  257
• 氢给体数：
  10
• 氢受体数：
  14