S-acetoacetyl coenzyme A | 1420-36-6

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: S-acetoacetyl coenzyme A
• 英文别名: acetoacetyl CoA；S-acetoacetyl-coenzyme-A；Acetoacetyl-CoA；Acetoacetyl-coenzyme a；S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxobutanethioate
• CAS: 1420-36-6
• 化学式: C₂₅H₄₀N₇O₁₈P₃S
• 分子量: 851.616
• InChiKey: OJFDKHTZOUZBOS-XBTRWLRFSA-N

物化性质

• 溶解度：
  在水中的溶解度50 mg/mL，澄清，无色至淡黄色

计算性质

• 辛醇/水分配系数(LogP)：
  -5.8
• 重原子数：
  54
• 可旋转键数：
  22
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  406
• 氢给体数：
  9
• 氢受体数：
  23

安全信息

• WGK Germany：
  3

反应信息

• 作为反应物：
  描述：

  S-acetoacetyl coenzyme A 生成 acetoacetic acid anion
  参考文献：
  名称：

  丙二酸S-硫酯，包括S-丙二酰基辅酶A的异常消除-加成（酮介导）

  摘要：

  丙二酸的S-单酯，包括S-丙二酰基辅酶A本身，通过新型的质子辅助（酮介导的）E 1cB途径进行氨解。

  DOI：

  10.1039/c39820000245

文献信息

• Molecular switches
  申请人：INTREXON CORPORATION

  公开号：US11198877B2

  公开（公告）日：2021-12-14

  Genetically modified microorganisms that have the ability to convert carbon substrates into chemical products such as 2,3-BDO; 1,4-BDO; isobutyraldehyde; isobutanol; 1-butanol; n-butanol; ethanol; fatty alcohols; and fatty acid methyl ester are disclosed. For example, genetically modified methanotrophs that are capable of generating 2,3-BDO; 1,4-BDO; isobutyraldehyde; isobutanol; 1-butanol; n-butanol; ethanol; fatty alcohols; and fatty acid methyl ester at high titers from a methane source are disclosed. Methods of making these genetically modified microorganisms and methods of using them are also disclosed. These microorganisms and methods make use of molecular switches to regulate gene expression.

  已公开的转基因微生物具有将碳底物转化为化学产品的能力，如 2,3-BDO；1,4-BDO；异丁醛；异丁醇；1-丁醇；正丁醇；乙醇；脂肪醇和脂肪酸甲酯。例如，公开了能够从甲烷源产生高滴度的 2,3-BDO；1,4-BDO；异丁醛；异丁醇；1-丁醇；正丁醇；乙醇；脂肪醇和脂肪酸甲酯的转基因甲烷营养体。还公开了制造这些转基因微生物的方法和使用它们的方法。这些微生物和方法利用分子开关来调节基因表达。
• [EN] METHOD FOR RECONSTRUCTING COMPLEX BIOLOGICAL SYSTEM ON THE BASIS OF POLYPROTEIN, AND USE THEREOF IN HIGH ACTIVITY SUPER SIMPLIFIED NITROGEN FIXATION SYSTEM CONSTRUCTION<br/>[FR] PROCÉDÉ DE RECONSTRUCTION D'UN SYSTÈME BIOLOGIQUE COMPLEXE SUR LA BASE DE POLYPROTÉINE ET UTILISATION CORRESPONDANTE DANS LA CONSTRUCTION D'UN SYSTÈME DE FIXATION D'AZOTE SUPER-SIMPLIFIÉ À HAUTE ACTIVITÉ<br/>[ZH] 基于多聚蛋白对复杂生物系统的重构方法，及其在高活性超简化固氮体系构建中的应用
  申请人：UNIV BEIJING

  公开号：WO2019213939A1

  公开（公告）日：2019-11-14

  提供了表达方法、载体和载体组合物。具体而言，提供了用于在宿主细胞中外源表达复杂生物学系统的方法，以及用于所述方法的载体和载体组合物。
• MOLECULAR SWITCHES
  申请人：Intrexon Corporation

  公开号：EP3574092A1

  公开（公告）日：2019-12-04
• MICROBIOLOGICAL PRODUCTION OF 3-HYDROXYISOBUTYRIC ACID
  申请人：Marx Achim

  公开号：US20100068773A1

  公开（公告）日：2010-03-18

  The present invention relates to a cell which has been modified in comparison with its wild type in such a way that it is capable of forming more, by comparison with its wild, 3-hydroxyisobutyric acid or poly-hydroxyalkanoates based on 3-hydroxyisobutyric acid via methylmalonate-semialdehyde or 3-hydroxybutyryl-coenzyme A as precursors. The invention also relates to a method of generating a genetically modified cell, to the genetically modified cell obtainable by these methods, to a method of producing 3-hydroxyisobutyric acid or polyhydroxyalkanoates based on 3-hydroxyisobutyric acid, to a method of producing methacrylic acid or methacrylic esters, and to a method of producing polymethacrylic acid or polymethacrylic esters. The present invention furthermore relates to an isolated DNA, to a vector, to the use of this vector for transforming a cell, to a transformed cell, and to a polypeptide.
• [EN] MOLECULAR SWITCHES<br/>[FR] COMMUTATEURS MOLÉCULAIRES
  申请人：INTREXON CORP

  公开号：WO2018140936A1

  公开（公告）日：2018-08-02

  Genetically modified microorganisms that have the ability to convert carbon substrates into chemical products such as 2,3-BDO; 1,4-BDO; isobutyraldehyde; isobutanol; 1-butanol; n-butanol; ethanol; fatty alcohols; and fatty acid methyl ester are disclosed. For example, genetically modified methanotrophs that are capable of generating 2,3-BDO; 1,4-BDO; isobutyraldehyde; isobutanol; 1-butanol; n-butanol; ethanol; fatty alcohols; and fatty acid methyl ester at high titers from a methane source are disclosed. Methods of making these genetically modified microorganisms and methods of using them are also disclosed. These microorganisms and methods make use of molecular switches to regulate gene expression.