6,7,8,11,12,23,24,27,28,29,41,42,43,46,47,48,54-Heptadecahydroxy-2,33,37,52,55-pentaoxaundecacyclo[33.18.2.04,9.010,19.013,18.016,25.017,22.026,31.036,53.039,44.045,50]pentapentaconta-4,6,8,10(19),11,13(18),16(25),17(22),23,26,28,30,39,41,43,45,47,49-octadecaene-3,15,20,32,38,51-hexone

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 单宁
• 英文名称: 6,7,8,11,12,23,24,27,28,29,41,42,43,46,47,48,54-Heptadecahydroxy-2,33,37,52,55-pentaoxaundecacyclo[33.18.2.04,9.010,19.013,18.016,25.017,22.026,31.036,53.039,44.045,50]pentapentaconta-4,6,8,10(19),11,13(18),16(25),17(22),23,26,28,30,39,41,43,45,47,49-octadecaene-3,15,20,32,38,51-hexone
• 英文别名: 6,7,8,11,12,23,24,27,28,29,41,42,43,46,47,48,54-heptadecahydroxy-2,33,37,52,55-pentaoxaundecacyclo[33.18.2.04,9.010,19.013,18.016,25.017,22.026,31.036,53.039,44.045,50]pentapentaconta-4,6,8,10(19),11,13(18),16(25),17(22),23,26,28,30,39,41,43,45,47,49-octadecaene-3,15,20,32,38,51-hexone
• 化学式: C₅₀H₃₂O₂₈
• 分子量: 1080.8
• InChiKey: ITHRCLOXJJMETN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  78
• 可旋转键数：
  0
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  493
• 氢给体数：
  17
• 氢受体数：
  28