4,9,15,16,18,23,30,43,45,49-Decahydroxy-33-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-2,20,26,28,39,44,47,50-octamethyl-10,12,37,41-tetramethylidene-34,55,56-trioxatricyclo[50.2.1.114,17]hexapentaconta-7,31,46,53-tetraene-24,35-dione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 4,9,15,16,18,23,30,43,45,49-Decahydroxy-33-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-2,20,26,28,39,44,47,50-octamethyl-10,12,37,41-tetramethylidene-34,55,56-trioxatricyclo[50.2.1.114,17]hexapentaconta-7,31,46,53-tetraene-24,35-dione
• 英文别名: 4,9,15,16,18,23,30,43,45,49-decahydroxy-33-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-2,20,26,28,39,44,47,50-octamethyl-10,12,37,41-tetramethylidene-34,55,56-trioxatricyclo[50.2.1.114,17]hexapentaconta-7,31,46,53-tetraene-24,35-dione
• 化学式: C₈₁H₁₃₂O₂₀
• 分子量: 1425.9
• InChiKey: MLRHUCKPGBGLBD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.9
• 重原子数：
  101
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  354
• 氢给体数：
  14
• 氢受体数：
  20