4-[2,4-Dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-25-(2-hydroxyethoxy)-12-(2-hydroxyethyl)-29-(hydroxymethyl)-30-oxa-8,9-dithiaoctacyclo[15.10.2.27,15.14,27.110,14.02,7.018,23.024,28]tritriaconta-1(28),11,18(23),19,21,24,26-heptaene-3,20-diol

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 黄酮类化合物
• 英文名称: 4-[2,4-Dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-25-(2-hydroxyethoxy)-12-(2-hydroxyethyl)-29-(hydroxymethyl)-30-oxa-8,9-dithiaoctacyclo[15.10.2.27,15.14,27.110,14.02,7.018,23.024,28]tritriaconta-1(28),11,18(23),19,21,24,26-heptaene-3,20-diol
• 英文别名: 4-[2,4-dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-25-(2-hydroxyethoxy)-12-(2-hydroxyethyl)-29-(hydroxymethyl)-30-oxa-8,9-dithiaoctacyclo[15.10.2.27,15.14,27.110,14.02,7.018,23.024,28]tritriaconta-1(28),11,18(23),19,21,24,26-heptaene-3,20-diol
• 化学式: C₄₇H₅₈O₁₁S₂
• 分子量: 863.1
• InChiKey: DBTQBCTYKTVJRD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  60
• 可旋转键数：
  12
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  229
• 氢给体数：
  7
• 氢受体数：
  13