6-(4-Aminobutyl)-48,49,63,64-tetramethoxy-1,4,7,15,18,21,24,32,37,45,52,60-dodecazaheptacyclo[19.13.13.134,18.19,13.126,30.139,43.154,58]tetrahexaconta-9,11,13(63),26(49),27,29,39,41,43(48),54(64),55,57-dodecaene-8,14,25,31,38,44,53,59-octone;(2,5-dioxopyrrolidin-1-yl) 5-oxohexanoate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 6-(4-Aminobutyl)-48,49,63,64-tetramethoxy-1,4,7,15,18,21,24,32,37,45,52,60-dodecazaheptacyclo[19.13.13.134,18.19,13.126,30.139,43.154,58]tetrahexaconta-9,11,13(63),26(49),27,29,39,41,43(48),54(64),55,57-dodecaene-8,14,25,31,38,44,53,59-octone;(2,5-dioxopyrrolidin-1-yl) 5-oxohexanoate
• 英文别名: 6-(4-aminobutyl)-48,49,63,64-tetramethoxy-1,4,7,15,18,21,24,32,37,45,52,60-dodecazaheptacyclo[19.13.13.134,18.19,13.126,30.139,43.154,58]tetrahexaconta-9,11,13(63),26(49),27,29,39,41,43(48),54(64),55,57-dodecaene-8,14,25,31,38,44,53,59-octone;(2,5-dioxopyrrolidin-1-yl) 5-oxohexanoate
• 化学式: C70H94N14O17
• 分子量: 1403.6
• InChiKey: IDPDFBZTLZUYEA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.76
• 重原子数：
  101
• 可旋转键数：
  14
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  389
• 氢给体数：
  9
• 氢受体数：
  22