19-[2,4-Dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-23-(2-hydroxyethoxy)-14-(hydroxymethyl)-8-pyrrol-1-id-3-ylspiro[20-oxa-2,3,11,12-tetrathianonacyclo[17.16.2.01,17.04,9.06,33.014,31.015,24.016,21.025,30]heptatriaconta-8,15,21,23,25(30),26,28-heptaene-10,1'-cyclopentane]-18,28-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: 19-[2,4-Dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-23-(2-hydroxyethoxy)-14-(hydroxymethyl)-8-pyrrol-1-id-3-ylspiro[20-oxa-2,3,11,12-tetrathianonacyclo[17.16.2.01,17.04,9.06,33.014,31.015,24.016,21.025,30]heptatriaconta-8,15,21,23,25(30),26,28-heptaene-10,1'-cyclopentane]-18,28-diol
• 英文别名: 19-[2,4-dihydroxy-3-methoxy-5-(3-methylbutoxy)phenyl]-23-(2-hydroxyethoxy)-14-(hydroxymethyl)-8-pyrrol-1-id-3-ylspiro[20-oxa-2,3,11,12-tetrathianonacyclo[17.16.2.01,17.04,9.06,33.014,31.015,24.016,21.025,30]heptatriaconta-8,15,21,23,25(30),26,28-heptaene-10,1'-cyclopentane]-18,28-diol
• 化学式: C55H64NO10S4-
• 分子量: 1027.4
• InChiKey: BCGWARYMXBGMOW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  70
• 可旋转键数：
  11
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  261
• 氢给体数：
  6
• 氢受体数：
  15