S-[2-[3-[[(2R)-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-methylbut-2-enethioate;hydrate

• 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-[2-[3-[[(2R)-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-methylbut-2-enethioate;hydrate
• 化学式: C26H44N7O18P3S
• 分子量: 867.7
• InChiKey: LJZCXMUARRUAAG-WADKRTIVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.19
• 重原子数：
  55
• 可旋转键数：
  21
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  390
• 氢给体数：
  10
• 氢受体数：
  23

文献信息

• METHODS FOR BIOSYNTHESIS OF ISOBUTENE
  申请人：Invista Technologies S.A R.L.

  公开号：EP2925871A1

  公开（公告）日：2015-10-07
• Methods for Biosynthesis of Isobutene
  申请人：INVISTA North America S.á r.l.

  公开号：US20140186913A1

  公开（公告）日：2014-07-03

  The document provides methods for biosynthesizing isobutene using one or more isolated enzymes such as one or more of an enoyl-CoA dehydratase, a 2-hydroxyacyl-CoA dehydratase, an isovaleryl-CoA/acyl-CoA dehydrogenase and a mevalonate diphosphate decarboxylase, or using recombinant host cells expressing one or more such enzymes.
• US9777295B2
  申请人：——

  公开号：US9777295B2

  公开（公告）日：2017-10-03
• [EN] METHODS FOR BIOSYNTHESIS OF ISOBUTENE<br/>[FR] PROCÉDÉS DE BIOSYNTHÈSE D'ISOBUTÈNE
  申请人：INVISTA NORTH AMERICA S Á R L

  公开号：WO2014085612A1

  公开（公告）日：2014-06-05

  The document provides methods for biosynthesizing isobutene using one or more isolated enzymes such as one or more of an enoyl-CoA dehydratase, a 2-hydroxyacyl-CoA dehydratase, an isovaleryl-CoA / acyl-CoA dehydrogenase and a mevalonate diphosphate decarboxylase, or using recombinant host cells expressing one or more such enzymes.