(53-Amino-11,31-dihydroxy-7-oxo-4-phenylspiro[13-oxa-38,39-dithia-8,52,54-triazatridecacyclo[38.10.4.214,20.233,36.15,8.110,22.144,47.01,5.012,21.014,18.024,29.027,32.040,44]henhexaconta-10,12(21),22(58),52-tetraen-49-yne-35,1'-cyclopentane]-29-yl) acetate

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (53-Amino-11,31-dihydroxy-7-oxo-4-phenylspiro[13-oxa-38,39-dithia-8,52,54-triazatridecacyclo[38.10.4.214,20.233,36.15,8.110,22.144,47.01,5.012,21.014,18.024,29.027,32.040,44]henhexaconta-10,12(21),22(58),52-tetraen-49-yne-35,1'-cyclopentane]-29-yl) acetate
• 英文别名: (53-amino-11,31-dihydroxy-7-oxo-4-phenylspiro[13-oxa-38,39-dithia-8,52,54-triazatridecacyclo[38.10.4.214,20.233,36.15,8.110,22.144,47.01,5.012,21.014,18.024,29.027,32.040,44]henhexaconta-10,12(21),22(58),52-tetraen-49-yne-35,1'-cyclopentane]-29-yl) acetate
• 化学式: C₆₇H₈₈N₄O₆S₂
• 分子量: 1109.6
• InChiKey: JQJFRVJPPUWMQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.8
• 重原子数：
  79
• 可旋转键数：
  3
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  197
• 氢给体数：
  4
• 氢受体数：
  9