(49-Amino-11,27-dihydroxy-7-oxo-4-phenylspiro[13-oxa-34,35-dithia-8,48,50-triazaundecacyclo[34.10.4.214,20.225,28.15,8.110,22.140,43.01,5.012,21.014,18.036,40]heptapentaconta-10,12(21),22(54),48,55-pentaen-45-yne-32,1'-cyclopentane]-25-yl) acetate

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (49-Amino-11,27-dihydroxy-7-oxo-4-phenylspiro[13-oxa-34,35-dithia-8,48,50-triazaundecacyclo[34.10.4.214,20.225,28.15,8.110,22.140,43.01,5.012,21.014,18.036,40]heptapentaconta-10,12(21),22(54),48,55-pentaen-45-yne-32,1'-cyclopentane]-25-yl) acetate
• 英文别名: (49-amino-11,27-dihydroxy-7-oxo-4-phenylspiro[13-oxa-34,35-dithia-8,48,50-triazaundecacyclo[34.10.4.214,20.225,28.15,8.110,22.140,43.01,5.012,21.014,18.036,40]heptapentaconta-10,12(21),22(54),48,55-pentaen-45-yne-32,1'-cyclopentane]-25-yl) acetate
• 化学式: C₆₃H₈₂N₄O₆S₂
• 分子量: 1055.5
• InChiKey: VANDGWKHPMMTJU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.3
• 重原子数：
  75
• 可旋转键数：
  3
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  197
• 氢给体数：
  4
• 氢受体数：
  9