(3R,4S,5S,6R,7R,9R,10S,11S,12R,13S,14R)-10-(2-aminoethylamino)-14-ethyl-7,12,13-trihydroxy-6-(3-hydroxy-4,6-dimethyloxan-2-yl)oxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one;(5S)-5-(aminomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one;butanedioic acid;4-[2-[[(2R,3S,4R,5S,6S,7R,9R,10R,11S,12S,13R)-2-ethyl-3,4,9-trihydroxy-10-(3-hydroxy-4,6-dimethyloxan-2-yl)oxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-14-oxo-oxacyclotetradec-6-yl]amino]ethylamino]-4-oxobutanoic acid

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: (3R,4S,5S,6R,7R,9R,10S,11S,12R,13S,14R)-10-(2-aminoethylamino)-14-ethyl-7,12,13-trihydroxy-6-(3-hydroxy-4,6-dimethyloxan-2-yl)oxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecan-2-one;(5S)-5-(aminomethyl)-3-(3-fluoro-4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one;butanedioic acid;4-[2-[[(2R,3S,4R,5S,6S,7R,9R,10R,11S,12S,13R)-2-ethyl-3,4,9-trihydroxy-10-(3-hydroxy-4,6-dimethyloxan-2-yl)oxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-14-oxo-oxacyclotetradec-6-yl]amino]ethylamino]-4-oxobutanoic acid
• 化学式: C98H172FN7O34
• 分子量: 2011.4
• InChiKey: VGKSXGXEUUVHJO-ZXHWAPLBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.58
• 重原子数：
  140
• 可旋转键数：
  28
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  606
• 氢给体数：
  18
• 氢受体数：
  40