1-[[2-[(1S,18S,28S,29S,30S)-30-[(2S,4S,5R,6S)-5-(dimethylamino)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-52-hydroxy-18-[(1R)-1-hydroxyethyl]-21-(1-methoxyethylidene)-9,16,19,26,31,42,46-heptaoxo-32,43,54-trioxa-3,13,23,49-tetrathia-7,17,20,27,45,51,52,55,56,57-decazadecacyclo[26.16.6.229,40.12,5.112,15.122,25.138,41.147,50.06,11.034,39]heptapentaconta-2(57),4,6,10,12(56),14,22(55),24,34(39),35,37,40,47,50-tetradecaen-8-ylidene]-3H-1,3-thiazol-4-yl]methyl]-3-(2-morpholin-4-ylethyl)urea

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-[[2-[(1S,18S,28S,29S,30S)-30-[(2S,4S,5R,6S)-5-(dimethylamino)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-52-hydroxy-18-[(1R)-1-hydroxyethyl]-21-(1-methoxyethylidene)-9,16,19,26,31,42,46-heptaoxo-32,43,54-trioxa-3,13,23,49-tetrathia-7,17,20,27,45,51,52,55,56,57-decazadecacyclo[26.16.6.229,40.12,5.112,15.122,25.138,41.147,50.06,11.034,39]heptapentaconta-2(57),4,6,10,12(56),14,22(55),24,34(39),35,37,40,47,50-tetradecaen-8-ylidene]-3H-1,3-thiazol-4-yl]methyl]-3-(2-morpholin-4-ylethyl)urea
• 化学式: C₆₅H₇₁N₁₅O₁₈S₅
• 分子量: 1510.7
• InChiKey: ICYUQKSMCPMAKV-SQJVXWSWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  103
• 可旋转键数：
  10
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  560
• 氢给体数：
  10
• 氢受体数：
  31