5-[[6-Amino-5-[2-[[6-amino-2-[[7-(1,1-difluoroethyl)-2-(1-hydroxyethylamino)-4-methylnona-4,6,8-trienoyl]amino]-1-hydroxyhexyl]amino]propanoylamino]-6-oxohexyl]carbamoyl]-2-(15-hydroxy-14-methyl-6-oxo-2-oxatricyclo[9.5.0.03,9]hexadeca-1(16),3,7,9,11-pentaen-10-yl)benzoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 5-[[6-Amino-5-[2-[[6-amino-2-[[7-(1,1-difluoroethyl)-2-(1-hydroxyethylamino)-4-methylnona-4,6,8-trienoyl]amino]-1-hydroxyhexyl]amino]propanoylamino]-6-oxohexyl]carbamoyl]-2-(15-hydroxy-14-methyl-6-oxo-2-oxatricyclo[9.5.0.03,9]hexadeca-1(16),3,7,9,11-pentaen-10-yl)benzoic acid
• 英文别名: 5-[[6-amino-5-[2-[[6-amino-2-[[7-(1,1-difluoroethyl)-2-(1-hydroxyethylamino)-4-methylnona-4,6,8-trienoyl]amino]-1-hydroxyhexyl]amino]propanoylamino]-6-oxohexyl]carbamoyl]-2-(15-hydroxy-14-methyl-6-oxo-2-oxatricyclo[9.5.0.03,9]hexadeca-1(16),3,7,9,11-pentaen-10-yl)benzoic acid
• 化学式: C₅₃H₇₁F₂N₇O₁₁
• 分子量: 1020.2
• InChiKey: KMMKDRINPRKDJR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  73
• 可旋转键数：
  27
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  305
• 氢给体数：
  11
• 氢受体数：
  16