30,31,32,45-Tetrahydroxy-29-(hydroxymethyl)-43-[[3-(hydroxymethyl)phenyl]methyl]-34,48-dioxa-3,4-dithia-6,8-diazatridecacyclo[33.10.2.111,27.129,33.01,41.05,21.07,23.010,24.013,25.016,25.017,22.026,31.039,47]nonatetraconta-7(23),10(24),17(22),18,20,35,37,39(47),42,44-decaene-40,46-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: 30,31,32,45-Tetrahydroxy-29-(hydroxymethyl)-43-[[3-(hydroxymethyl)phenyl]methyl]-34,48-dioxa-3,4-dithia-6,8-diazatridecacyclo[33.10.2.111,27.129,33.01,41.05,21.07,23.010,24.013,25.016,25.017,22.026,31.039,47]nonatetraconta-7(23),10(24),17(22),18,20,35,37,39(47),42,44-decaene-40,46-dione
• 英文别名: 30,31,32,45-tetrahydroxy-29-(hydroxymethyl)-43-[[3-(hydroxymethyl)phenyl]methyl]-34,48-dioxa-3,4-dithia-6,8-diazatridecacyclo[33.10.2.111,27.129,33.01,41.05,21.07,23.010,24.013,25.016,25.017,22.026,31.039,47]nonatetraconta-7(23),10(24),17(22),18,20,35,37,39(47),42,44-decaene-40,46-dione
• 化学式: C₅₂H₅₀N₂O₁₀S₂
• 分子量: 927.1
• InChiKey: XPZXRTLVUAPFBB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  66
• 可旋转键数：
  4
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  249
• 氢给体数：
  8
• 氢受体数：
  14