36'-[1-(4,7-Dihydroxynaphthalen-1-yl)-2,3,4,5,6-pentahydroxyhexan-2-yl]-6,11'-diethyl-6'-methylspiro[3-azatricyclo[5.2.2.04,8]undecane-2,32'-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.319,29.216,19.110,13.112,15.03,8.09,43.023,27.028,40.031,41.033,39.041,45.023,50]tetrapentaconta-1,3(8),5,9(43),11,13(54),15(53),17,29,33(39),34-undecaene]-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]-6,11'-diethyl-6'-methylspiro[3-azatricyclo[5.2.2.04,8]undecane-2,32'-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.319,29.216,19.110,13.112,15.03,8.09,43.023,27.028,40.031,41.033,39.041,45.023,50]tetrapentaconta-1,3(8),5,9(43),11,13(54),15(53),17,29,33(39),34-undecaene]-4',24'-dione
• 英文别名: 36'-[1-(4,7-dihydroxynaphthalen-1-yl)-2,3,4,5,6-pentahydroxyhexan-2-yl]-6,11'-diethyl-6'-methylspiro[3-azatricyclo[5.2.2.04,8]undecane-2,32'-7,42,46,47-tetraoxa-10,14,25-triazatetradecacyclo[34.7.4.319,29.216,19.110,13.112,15.03,8.09,43.023,27.028,40.031,41.033,39.041,45.023,50]tetrapentaconta-1,3(8),5,9(43),11,13(54),15(53),17,29,33(39),34-undecaene]-4',24'-dione
• 化学式: C₇₇H₈₆N₄O₁₃
• 分子量: 1275.5
• InChiKey: NJCQHMGRUYNBJF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.6
• 重原子数：
  94
• 可旋转键数：
  9
• 环数：
  22.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  257
• 氢给体数：
  10
• 氢受体数：
  14