癸利酮杂质2(辅酶Q10) | 65085-29-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 中文名称: 癸利酮杂质2(辅酶Q10)
• 英文名称: 2-((2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyl-tetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl)-5,6-dimethoxy-3-methyl-[1,4]benzoquinone
• 英文别名: Coenzyme Q10, (2Z)-；2-[(2Z,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
• CAS: 65085-29-2
• 化学式: C₅₉H₉₀O₄
• 分子量: 863.361
• InChiKey: ACTIUHUUMQJHFO-LLOLQPSSSA-N

物化性质

• 沸点：
  869.0±65.0 °C(Predicted)
• 密度：
  0.97±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  19.4
• 重原子数：
  63
• 可旋转键数：
  31
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  4-(((6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl)oxy)-2,3-dimethoxy-6-methylphenyl benzoate 在 甲醇 、 manganese(IV) oxide 、 氢氧化钾 、 三氟化硼乙醚 作用下， 以 四氯化碳 、 乙醚 为溶剂， 生成 癸利酮杂质2(辅酶Q10)
  参考文献：
  名称：

  三氟化硼促进的聚异戊二烯 2,3,4,5-四取代苯醚的区域选择性聚异戊二烯重排

  摘要：

  通过BF3·OEt2催化聚异戊二烯基4-乙酰氧基-2,3重排，选择性地获得4-乙酰氧基-6-聚异戊二烯基-2,3,5-三甲基苯酚或2,3-二甲氧基-5-甲基-6-聚异戊二烯基氢醌， 5-三甲基苯基醚或聚异戊二烯基 2,3-二甲氧基-4-羟基-5-甲基苯基醚。

  DOI：

  10.1246/cl.1982.1131

文献信息

• A Novel Solvent Effect in the Practical Synthesis of Ubiquinone-10
  作者：Hirozumi Eto、Chikahiko Eguchi

  DOI：10.1246/cl.1988.1597

  日期：1988.10.5

  The mixed solvent of nitromethane and hexane exhibited high stereoselectivity with good yields in the synthesis of ubiquinone-10 by the coupling of 2,3-dimethoxy-5-methylhydroquinone and isodecaprenol in the presence of a catalytic amount of BF3·OEt2.

  混合溶剂的硝基甲烷和己烷在催化剂量的BF3·OEt2存在下，通过2,3-二甲氧基-5-甲基氢醌和异脱萜醇的偶联合成了辅酶Q10，展现出很高的立体选择性和良好的产率。
• COENZYME Q10-CONTAINING WATER-SOLUBLE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF
  申请人：Ikehara Toshinori

  公开号：US20100284983A1

  公开（公告）日：2010-11-11

  A coenzyme Q 10 -containing water soluble composition comprises coenzyme Q 10 , a hydrophilic polyglycerol fatty acid ester, a lipophilic sucrose fatty acid ester and an aqueous phase component and a process for producing the same are disclosed. A coenzyme Q 10 -containing water-soluble dry powder can be obtained by drying the above-mentioned coenzyme Q 10 -containing water soluble composition. A food, functional food, beverage, pharmaceutical product, quasi drug, cosmetic, or animal food can be obtained by using the above-mentioned coenzyme Q 10 -containing water soluble composition or the above-mentioned coenzyme Q 10 -containing water-soluble dry powder. The coenzyme Q 10 -containing water soluble composition has a high bioavailability, and maintains a stable emulsion form for a long period of time from refrigeration temperature to room temperature and allows efficient supply.
• US8388950B2
  申请人：——

  公开号：US8388950B2

  公开（公告）日：2013-03-05
• REGIOSELECTIVE POLYPRENYL REARRANGEMENT OF POLYPRENYL 2,3,4,5-TETRASUBSTITUTED PHENYL ETHERS PROMOTED BY BORON TRIFLUORIDE
  作者：Toyokichi Yoshizawa、Hatsunori Toyofuku、Koichi Tachibana、Toshio Kuroda

  DOI：10.1246/cl.1982.1131

  日期：1982.8.5

  ,3,5-trimethylphenols or 2,3-dimethoxy-5-methyl-6-polyprenylhydroquinones were obtained selectively by the BF3·OEt2 catalyzed polyprenyl rearrangement of polyprenyl 4-acetoxy-2,3,5-trimethylphenyl ethers or polyprenyl 2,3-dimethoxy-4-hydroxy-5-methylphenyl ethers.

  通过BF3·OEt2催化聚异戊二烯基4-乙酰氧基-2,3重排，选择性地获得4-乙酰氧基-6-聚异戊二烯基-2,3,5-三甲基苯酚或2,3-二甲氧基-5-甲基-6-聚异戊二烯基氢醌， 5-三甲基苯基醚或聚异戊二烯基 2,3-二甲氧基-4-羟基-5-甲基苯基醚。