[(6S,7R,8aS)-7-acetamido-6-butanoyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] butanoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 糖脂
• 英文名称: [(6S,7R,8aS)-7-acetamido-6-butanoyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] butanoate
• 化学式: C₁₉H₃₁NO₈
• 分子量: 401.5
• InChiKey: JMWTYDSADOQEPC-QZHDQGLJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  28
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  109
• 氢给体数：
  1
• 氢受体数：
  8

文献信息

• HYBRID SCFA-HYDROXYL-DERIVATIZED MONOSACCHARIDES, METHODS OF SYNTHESIS, AND METHODS OF TREATING DISORDERS
  申请人：The Johns Hopkins University

  公开号：US20140220630A1

  公开（公告）日：2014-08-07

  Described herein are fatty acid carbohydrate-hydroxyl-hybrid compounds and derivatives thereof, and methods of treating or preventing disease and disease symptoms using the compounds and compositions thereof.