6-(4-Hydroxy-1-methoxybutan-2-yl)-7-(hydroxymethyl)-39-(1-hydroxypropan-2-ylidene)-13-methyl-30-[3-(1-phenylcyclohexyl)phenyl]-4,12,35,37-tetraoxaoctacyclo[21.12.6.122,26.02,11.03,8.013,36.014,19.027,32]dotetraconta-2(11),3(8),6,9,22,24,26(42),28-octaene-5,34,38-trione

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 6-(4-Hydroxy-1-methoxybutan-2-yl)-7-(hydroxymethyl)-39-(1-hydroxypropan-2-ylidene)-13-methyl-30-[3-(1-phenylcyclohexyl)phenyl]-4,12,35,37-tetraoxaoctacyclo[21.12.6.122,26.02,11.03,8.013,36.014,19.027,32]dotetraconta-2(11),3(8),6,9,22,24,26(42),28-octaene-5,34,38-trione
• 英文别名: 6-(4-hydroxy-1-methoxybutan-2-yl)-7-(hydroxymethyl)-39-(1-hydroxypropan-2-ylidene)-13-methyl-30-[3-(1-phenylcyclohexyl)phenyl]-4,12,35,37-tetraoxaoctacyclo[21.12.6.122,26.02,11.03,8.013,36.014,19.027,32]dotetraconta-2(11),3(8),6,9,22,24,26(42),28-octaene-5,34,38-trione
• 化学式: C₆₆H₇₆O₁₁
• 分子量: 1045.3
• InChiKey: CNMBHWBKLUTOCS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.2
• 重原子数：
  77
• 可旋转键数：
  10
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  158
• 氢给体数：
  3
• 氢受体数：
  11