(54-Amino-11,27-dihydroxy-7-oxo-4-phenyl-13-oxa-39,40-dithia-8,53,55-triazatetradecacyclo[39.10.4.214,20.225,28.229,37.15,8.110,22.129,36.145,48.01,5.012,21.014,18.032,36.041,45]pentahexaconta-10,12(21),22(62),53,63-pentaen-50-yn-25-yl) acetate

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (54-Amino-11,27-dihydroxy-7-oxo-4-phenyl-13-oxa-39,40-dithia-8,53,55-triazatetradecacyclo[39.10.4.214,20.225,28.229,37.15,8.110,22.129,36.145,48.01,5.012,21.014,18.032,36.041,45]pentahexaconta-10,12(21),22(62),53,63-pentaen-50-yn-25-yl) acetate
• 英文别名: (54-amino-11,27-dihydroxy-7-oxo-4-phenyl-13-oxa-39,40-dithia-8,53,55-triazatetradecacyclo[39.10.4.214,20.225,28.229,37.15,8.110,22.129,36.145,48.01,5.012,21.014,18.032,36.041,45]pentahexaconta-10,12(21),22(62),53,63-pentaen-50-yn-25-yl) acetate
• 化学式: C₆₇H₈₆N₄O₆S₂
• 分子量: 1107.6
• InChiKey: VMJYYBSKYHPSMH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.6
• 重原子数：
  79
• 可旋转键数：
  3
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  197
• 氢给体数：
  4
• 氢受体数：
  9