[(2S,3R,4R,6R)-4-hydroxy-2-methoxy-6-methyloxan-3-yl] benzoate | 618457-87-7

• 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: [(2S,3R,4R,6R)-4-hydroxy-2-methoxy-6-methyloxan-3-yl] benzoate
• CAS: 618457-87-7
• 化学式: C₁₄H₁₈O₅
• 分子量: 266.294
• InChiKey: DXHFRTBNTIVRQC-LHMODEAPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  65
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  [(2S,3R,4R,6R)-4-hydroxy-2-methoxy-6-methyloxan-3-yl] benzoate 在 盐酸 、 sodium tetrahydroborate 、 三氟化硼乙醚 、 sodium methylate 、 sodium acetate 、 pyridinium chlorochromate 作用下， 以 乙醚 、 二氯甲烷 为溶剂， 反应 65.17h， 生成 2,3-di-O-acetyl-4,6-dideoxy-α-D-ribo-hexopyranosyl chloride
  参考文献：
  名称：

  壮观霉素的化学：其全合成、立体控制重排和类似物

  摘要：

  基于区域特异性功能化和适当起始材料的操作，描述了抗生素壮观霉素的总立体控制合成。三级酮...

  DOI：

  10.1139/v85-026
• 作为产物：
  描述：

  methyl 4,6-dideoxy-α-D-glucopyranoside 、 苯甲酰氯 在 三丁基氧化锡 作用下， 以 甲苯 为溶剂， 以94%的产率得到[(2S,3R,4R,6R)-4-hydroxy-2-methoxy-6-methyloxan-3-yl] benzoate
  参考文献：
  名称：

  壮观霉素的化学：其全合成、立体控制重排和类似物

  摘要：

  基于区域特异性功能化和适当起始材料的操作，描述了抗生素壮观霉素的总立体控制合成。三级酮...

  DOI：

  10.1139/v85-026

文献信息

• Glycorandomization and production of novel vancomycin analogs
  申请人：Wisconsin Alumni Research Foundation

  公开号：US20040259228A1

  公开（公告）日：2004-12-23

  The present invention provides combinatorial methods for rapidly generating a diverse library of glycorandomized structures, comprising incubating one or more aglycons and a pool of NDP-sugars in the presence of a glycosyltransferase. The glycosyltransferase may be one that is associated with or involved in production of natural secondary metabolites, or one which is putatively associated with or involved in production of natural secondary metabolites. The glycosyltransferase may show significant flexibility with respect to its NDP-sugar donors and/or its aglycons. NDP-sugar donors may be commercially available, or may be produced by utilizing mutant or wild type nucleotidyltransferases significant flexibility with respect to their substrates.

  本发明提供了快速生成多种糖随机化结构库的组合方法，包括在糖基转移酶存在下培养一种或多种琼脂糖和NDP-糖池。糖基转移酶可以是与天然次生代谢物的生产有关或参与生产的糖基转移酶，也可以是推测与天然次生代谢物的生产有关或参与生产的糖基转移酶。糖基转移酶在其 NDP-糖供体和/或其糖醛酸方面可以表现出很大的灵活性。NDP 糖供体可以从市场上买到，也可以通过利用突变型或野生型核苷酸转移酶对底物的极大灵活性来生产。
• Glycorandomization and Production of Novel Vancomycin Analogs
  申请人：Thorson Jon

  公开号：US20080268504A1

  公开（公告）日：2008-10-30

  The present invention provides combinatorial methods for rapidly generating a diverse library of glycorandomized structures, comprising incubating one or more aglycons and a pool of NDP-sugars in the presence of a glycosyltransferase. The glycosyltransferase may be one that is associated with or involved in production of natural secondary metabolites, or one which is putatively associated with or involved in production of natural secondary metabolites. The glycosyltransferase may show significant flexibility with respect to its NDP-sugar donors and/or its aglycons. NDP-sugar donors may be commercially available, or may be produced by utilizing mutant or wild type nucleotidyltransferases significant flexibility with respect to their substrates.
• Glycorandomization and Production of Novel Novobiocin Analogs
  申请人：Thorson Jon

  公开号：US20120264924A1

  公开（公告）日：2012-10-18

  The present invention provides glycorandomized structures and combinatorial methods for rapidly generating a diverse library of glycorandomized structures, comprising incubating one or more aglycons and a pool of NDP-sugars in the presence of a glycosyltransferase. The glycosyltransferase may be one that is associated with or involved in production of natural secondary metabolites, or one which is putatively associated with or involved in production of natural secondary metabolites. The glycosyltransferase may show significant flexibility with respect to its NDP-sugar donors and/or its aglycons. NDP-sugar donors may be commercially available, or may be produced by utilizing mutant or wild type nucleotidyltransferases significant flexibility with respect to their substrates.
• US7348309B2
  申请人：——

  公开号：US7348309B2

  公开（公告）日：2008-03-25
• US8198419B2
  申请人：——

  公开号：US8198419B2

  公开（公告）日：2012-06-12