[3-[5-[3,5-Dihydroxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-5-hydroxy-4-(6-hydroxy-2,6-dimethylocta-2,7-dienoyl)oxy-6-(hydroxymethyl)oxan-2-yl] 10-[6-[[5-acetyloxy-3-[6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5,6-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

• 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: [3-[5-[3,5-Dihydroxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-5-hydroxy-4-(6-hydroxy-2,6-dimethylocta-2,7-dienoyl)oxy-6-(hydroxymethyl)oxan-2-yl] 10-[6-[[5-acetyloxy-3-[6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5,6-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• 英文别名: [3-[5-[3,5-dihydroxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-5-hydroxy-4-(6-hydroxy-2,6-dimethylocta-2,7-dienoyl)oxy-6-(hydroxymethyl)oxan-2-yl] 10-[6-[[5-acetyloxy-3-[6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5,6-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• 化学式: C₈₇H₁₃₆O₄₄
• 分子量: 1886.0
• InChiKey: MZJGXQOSSZBGIS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -4.5
• 重原子数：
  131
• 可旋转键数：
  31
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  669
• 氢给体数：
  21
• 氢受体数：
  44