(3R,4R,5R)-3,4-bis[(3,4-dimethoxyphenyl)methyl]-5-(5-methyl-2-propan-2-ylcyclohexyl)oxyoxolan-2-one | 135588-81-7

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物 - 呋喃类木脂素
• 英文名称: (3R,4R,5R)-3,4-bis[(3,4-dimethoxyphenyl)methyl]-5-(5-methyl-2-propan-2-ylcyclohexyl)oxyoxolan-2-one
• CAS: 135588-81-7；140223-76-3
• 化学式: C₃₂H₄₄O₇
• 分子量: 540.697
• InChiKey: TZYLCVVSEQLTEO-WWKFIRIHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  39
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  72.4
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  (3R,4R,5R)-3,4-bis[(3,4-dimethoxyphenyl)methyl]-5-(5-methyl-2-propan-2-ylcyclohexyl)oxyoxolan-2-one 在 氢氧化钾 、 sodium tetrahydroborate 作用下， 生成 甲基牛蒡酚; 甲基牛蒡子素
  参考文献：
  名称：

  Asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetraun and dibenzocyclooctadiene series

  摘要：

  General procedures are outlined for the asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetralin and dibenzocyclooctadiene series, from tandem addition products derived from 4-menthyloxybutenolide.

  DOI：

  10.1016/s0957-4166(00)80200-1
• 作为产物：
  描述：

  (3R,4R,5R)-3-<(3,4-Dimethoxyphenyl)methyl>-4-<(3,4-dimethoxyphenyl)bis(phenylthio)methyl>-5-(l-menthyloxy)dihydro-2(3H)-furanone 在 sodium tetrahydroborate 、 nickel dichloride 作用下， 以100%的产率得到(3R,4R,5R)-3,4-bis[(3,4-dimethoxyphenyl)methyl]-5-(5-methyl-2-propan-2-ylcyclohexyl)oxyoxolan-2-one
  参考文献：
  名称：

  Asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetraun and dibenzocyclooctadiene series

  摘要：

  General procedures are outlined for the asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetralin and dibenzocyclooctadiene series, from tandem addition products derived from 4-menthyloxybutenolide.

  DOI：

  10.1016/s0957-4166(00)80200-1

文献信息

• Asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetraun and dibenzocyclooctadiene series
  作者：Andrew Pelter、Robert S. Ward、D.Martin Jones、Peter Maddocks

  DOI：10.1016/s0957-4166(00)80200-1

  日期：1992.1

  General procedures are outlined for the asymmetric syntheses of lignans of the dibenzylbutyrolactone, dibenzylbutanediol, aryltetralin and dibenzocyclooctadiene series, from tandem addition products derived from 4-menthyloxybutenolide.