(1R,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (1R,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
• 化学式: C₁₆H₁₈O₉
• 分子量: 354.31
• InChiKey: CWVRJTMFETXNAD-QHEBTOHLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.4
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  165
• 氢给体数：
  6
• 氢受体数：
  9

文献信息

• METHODS OF TREATING POLYCYSTIC OVARIAN SYNDROME USING CHLOROGENIC ACID AND INOSITOL
  申请人：Oculus Innovative Sciences, Inc.

  公开号：US20150283107A1

  公开（公告）日：2015-10-08

  The invention provides a method of treating or preventing polycystic ovarian syndrome (PCOS) in a mammal, comprising administering chlorogenic acid and inositol in an amount effective to treat or prevent PCOS in the mammal. In an embodiment of the invention, the method further comprises administering L-cysteine to the mammal.
• CYCLOHEXANECARBOXYLIC ACIDS FOR SELECTIVE TASTE MASKING
  申请人：INTERNATIONAL FLAVORS & FRAGRANCES INC.

  公开号：US20180110248A1

  公开（公告）日：2018-04-26

  The use of cyclohexanecarboxylic acids in a consumable to provide taste specific masking effect is provided.