Ethyl 31-formyl-24-[5-hydroxy-6-(3-hydroxypropyl)-2-(3-methoxypropyl)-1,3,4,4a,6,8a-hexahydroisoquinolin-5-yl]-4,18,27-tris(hydroxymethyl)-5-oxo-20,25,29-trioxa-12-azaheptacyclo[19.10.1.12,6.07,15.09,13.022,26.028,32]tritriaconta-1,7(15),8,10,13,21(32),22(26),27,30-nonaene-30-carboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: Ethyl 31-formyl-24-[5-hydroxy-6-(3-hydroxypropyl)-2-(3-methoxypropyl)-1,3,4,4a,6,8a-hexahydroisoquinolin-5-yl]-4,18,27-tris(hydroxymethyl)-5-oxo-20,25,29-trioxa-12-azaheptacyclo[19.10.1.12,6.07,15.09,13.022,26.028,32]tritriaconta-1,7(15),8,10,13,21(32),22(26),27,30-nonaene-30-carboxylate
• 英文别名: ethyl 31-formyl-24-[5-hydroxy-6-(3-hydroxypropyl)-2-(3-methoxypropyl)-1,3,4,4a,6,8a-hexahydroisoquinolin-5-yl]-4,18,27-tris(hydroxymethyl)-5-oxo-20,25,29-trioxa-12-azaheptacyclo[19.10.1.12,6.07,15.09,13.022,26.028,32]tritriaconta-1,7(15),8,10,13,21(32),22(26),27,30-nonaene-30-carboxylate
• 化学式: C₅₂H₆₄N₂O₁₃
• 分子量: 925.1
• InChiKey: GLNMXVMIJGEPMU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  67
• 可旋转键数：
  15
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  218
• 氢给体数：
  6
• 氢受体数：
  14