erythro-methyl (E)-7-<4'-fluoro-3,5-dimethyl-3'-<<<(1,1'-dimethylethyl)dimethylsilyl>oxy>methyl><1,1'-biphenyl>-2-yl>-3,5-dihydroxy-6-heptenoate | 99725-20-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: erythro-methyl (E)-7-<4'-fluoro-3,5-dimethyl-3'-<<<(1,1'-dimethylethyl)dimethylsilyl>oxy>methyl><1,1'-biphenyl>-2-yl>-3,5-dihydroxy-6-heptenoate
• 英文别名: threo-methyl (E)-7-<4'-fluoro-3,5-dimethyl-3'-<<<(1,1'-dimethylethyl)dimethylsilyl>oxy>methyl><1,1'-biphenyl>-2-yl>-3,5-dihydroxy-6-heptenoate；methyl (E)-7-(4'-fluoro-3,5-dimethyl-3'-[[(1,1-dimethylethyl)dimethylsilyl]oxymethyl][1,1'-biphenyl]-2-yl]-3,5-dihydroxy-6-heptenoate；erythro-methyl (E)-7-[4'-fluoro-3,5-dimethyl-3'-({[(1,1'-dimethylethyl)dimethylsilyl]oxy}methyl)(1,1'-biphenyl)-2-yl]-3,5-dihydroxy-6-heptenoate；threo-methyl (E)-7-[4'-fluoro-3,5-dimethyl-3'-({[(1,1'-dimethylethyl)dimethylsilyl]oxy}methyl)(1,1'-biphenyl)-2-yl]-3,5-dihydroxy-6-heptenoate；methyl (E)-7-[2-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluorophenyl]-4,6-dimethylphenyl]-3,5-dihydroxyhept-6-enoate
• CAS: 99725-20-9；99725-21-0；111858-34-5
• 化学式: C₂₉H₄₁FO₅Si
• 分子量: 516.725
• InChiKey: XWFIBDCETBUYJJ-ZHACJKMWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.32
• 重原子数：
  36
• 可旋转键数：
  12
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  76
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  erythro-methyl (E)-7-<4'-fluoro-3,5-dimethyl-3'-<<<(1,1'-dimethylethyl)dimethylsilyl>oxy>methyl><1,1'-biphenyl>-2-yl>-3,5-dihydroxy-6-heptenoate 生成 trans-(E)-6-[2-[4'-Fluoro-3,5-dimethyl-3'-[[(1,1-dimethylethyl)dimethylsilyl]oxymethyl][1,1'-biphenyl]-2-yl]ethenyl]-3,4,5,6-tetra-hydro-4-hydroxy-2H-pyran-2-one
  参考文献：
  名称：

  SMITH, ROBERT L.;STOKKER, GERALD E.

  摘要：

  DOI：
• 作为产物：
  描述：

  Methyl (E)-7-(4'-fluoro-3,5-dimethyl-3'-[ [(1,1-dimethylethyl)dimethylsilyl]oxymethyl][1,1'-biphenyl]-2-yl]-3-hydroxy-5-oxo-6-heptenoate 生成 erythro-methyl (E)-7-<4'-fluoro-3,5-dimethyl-3'-<<<(1,1'-dimethylethyl)dimethylsilyl>oxy>methyl><1,1'-biphenyl>-2-yl>-3,5-dihydroxy-6-heptenoate
  参考文献：
  名称：

  SMITH, ROBERT L.;STOKKER, GERALD E.

  摘要：

  DOI：

文献信息

• Antihypercholesterolemic compounds
  申请人：Merck & Co., Inc.

  公开号：US04772626A1

  公开（公告）日：1988-09-20

  Novel 3-hydroxy-3-methylglutaryl-coenzyme A (HMG-CoA) reductase inhibitors which are useful as antihypercholesterolemic agents and are represented by the following general structural formulae (I) and (II): ##STR1## and pharmaceutically acceptable salts of the compounds (II) in which Z is hydrogen are disclosed.

  本发明涉及一种小说的3-羟基-3-甲基戊二酰辅酶A（HMG-CoA）还原酶抑制剂，其可用作降低胆固醇的药物，其通式如下（I）和（II）：##STR1##以及化合物（II）的药学上可接受的盐，其中Z为氢。
• STOKKER, G. E.;ALBERTS, A. W.;ANDERSON, P. S.;CRAGOE, E. J. ,, JR.;DEANA,+, J. MED. CHEM., 1986, 29, N 2, 170-181
  作者：STOKKER, G. E.、ALBERTS, A. W.、ANDERSON, P. S.、CRAGOE, E. J. ,, JR.、DEANA,+

  DOI：——

  日期：——
• SMITH, ROBERT L.;STOKKER, GERALD E.
  作者：SMITH, ROBERT L.、STOKKER, GERALD E.

  DOI：——

  日期：——