[7-Hydroxy-15-[3-hydroxy-4-[3-hydroxy-5-(1-phenylpropyl)phenoxy]-5-methoxyphenyl]-30-(3-hydroxyphenyl)-6'-methyl-17-oxo-2-(3-oxobutyl)spiro[2,14,26,34-tetrazahexacyclo[29.3.1.03,12.06,11.010,14.024,28]pentatriaconta-1(35),3,5,10,12,24,27,31-octaene-22,5'-cyclohexa-1,3-diene]-19-yl] acetate

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物
• 英文名称: [7-Hydroxy-15-[3-hydroxy-4-[3-hydroxy-5-(1-phenylpropyl)phenoxy]-5-methoxyphenyl]-30-(3-hydroxyphenyl)-6'-methyl-17-oxo-2-(3-oxobutyl)spiro[2,14,26,34-tetrazahexacyclo[29.3.1.03,12.06,11.010,14.024,28]pentatriaconta-1(35),3,5,10,12,24,27,31-octaene-22,5'-cyclohexa-1,3-diene]-19-yl] acetate
• 英文别名: [7-hydroxy-15-[3-hydroxy-4-[3-hydroxy-5-(1-phenylpropyl)phenoxy]-5-methoxyphenyl]-30-(3-hydroxyphenyl)-6'-methyl-17-oxo-2-(3-oxobutyl)spiro[2,14,26,34-tetrazahexacyclo[29.3.1.03,12.06,11.010,14.024,28]pentatriaconta-1(35),3,5,10,12,24,27,31-octaene-22,5'-cyclohexa-1,3-diene]-19-yl] acetate
• 化学式: C₇₁H₇₆N₄O₁₀
• 分子量: 1145.4
• InChiKey: YHJOXOOTRLKFNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.6
• 重原子数：
  85
• 可旋转键数：
  13
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  196
• 氢给体数：
  6
• 氢受体数：
  12