5-[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-4-methyl-1,3-dihydropyrrol-2-one;5-[[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]-1-methylpyrrolidine-2,4-dione;5-[[(1R,2S,4aR,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-3,7,8-trimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]pyrrolidine-2,4-dione;5-[[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3-hydroxy-5-methylphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]pyrrolidine-2,4-dione

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 5-[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-4-methyl-1,3-dihydropyrrol-2-one;5-[[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]-1-methylpyrrolidine-2,4-dione;5-[[(1R,2S,4aR,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3,5-dihydroxyphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-3,7,8-trimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]pyrrolidine-2,4-dione;5-[[(1S,2R,4aS,7R,8S,8aS)-2-[[(2R,3R,6S,8R,11R)-2-(3-hydroxy-5-methylphenyl)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-8-yl]methyl]-7,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]pyrrolidine-2,4-dione
• 化学式: C144H196N4O26
• 分子量: 2399.1
• InChiKey: TVYPLHQVHXGMPO-YFHCRLRVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  27.62
• 重原子数：
  174
• 可旋转键数：
  17
• 环数：
  24.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  452
• 氢给体数：
  13
• 氢受体数：
  26