[(3R,4S,6R)-2-[[(3R,4S,5S,6R,7S,9R,11R,12R,13R,14R)-4-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11-pentamethyl-13-methylsulfonyloxy-2,10-dioxo-13-(trifluoromethyl)-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate;[(3R,4S,6R)-2-[[(1R,3R,6R,7S,8S,9R,10S,12R,13S,17S)-7-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3-ethyl-10-methoxy-6,8,10,12,15,15,17-heptamethyl-2,5-dioxo-4,14,16-trioxabicyclo[11.3.1]heptadecan-9-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate;[(3R,4S,6R)-2-[[(1R,2R,3R,6R,7S,8S,9R,10S,12R,13S,17S)-7-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3-ethyl-10-methoxy-2,6,8,10,12,15,15,17-octamethyl-5-oxo-2-(trifluoromethyl)-4,14,16-trioxabicyclo[11.3.1]heptadecan-9-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [(3R,4S,6R)-2-[[(3R,4S,5S,6R,7S,9R,11R,12R,13R,14R)-4-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11-pentamethyl-13-methylsulfonyloxy-2,10-dioxo-13-(trifluoromethyl)-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate;[(3R,4S,6R)-2-[[(1R,3R,6R,7S,8S,9R,10S,12R,13S,17S)-7-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3-ethyl-10-methoxy-6,8,10,12,15,15,17-heptamethyl-2,5-dioxo-4,14,16-trioxabicyclo[11.3.1]heptadecan-9-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate;[(3R,4S,6R)-2-[[(1R,2R,3R,6R,7S,8S,9R,10S,12R,13S,17S)-7-[(4R,5S,6S)-5-benzoyloxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3-ethyl-10-methoxy-2,6,8,10,12,15,15,17-octamethyl-5-oxo-2-(trifluoromethyl)-4,14,16-trioxabicyclo[11.3.1]heptadecan-9-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] benzoate
• 化学式: C163H237F6N3O46S
• 分子量: 3120.7
• InChiKey: MASFPYFFKDEEDV-AQABFSAPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  23.85
• 重原子数：
  219
• 可旋转键数：
  44
• 环数：
  17.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  556
• 氢给体数：
  1
• 氢受体数：
  55