caryophylla-4(12),8(13)-dien-5α-ol

• 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
• 英文名称: caryophylla-4(12),8(13)-dien-5α-ol
• 英文别名: caryophylla-4(12),8(13)-dien-5-ol；Caryophylla-4(12),8(13)-dien-5-ol；(1S,9R)-10,10-dimethyl-2,6-dimethylidenebicyclo[7.2.0]undecan-5-ol
• 化学式: C₁₅H₂₄O
• 分子量: 220.355
• InChiKey: CIIYOYPOMGIECX-ZFXTZCCVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  caryophyllene oxide 在 aluminum isopropoxide 作用下， 以 异丙醇 为溶剂， 反应 2.0h， 生成 caryophylla-2(12),6-dien-5-ol 、 caryophylla-4(12),8(13)-dien-5α-ol
  参考文献：
  名称：

  薰衣草油高沸点馏分中的新羰基化合物。第二次通讯†

  摘要：

  除了在[1]中报道的倍半萜类化合物外，对薰衣草油的深入分析还导致鉴定出了石竹素（1 – 6），雪松（7和8）和其他骨架（9 – 21）的新成分。讨论了这些化合物的光谱性质以及部分合成。

  DOI：

  10.1002/hlca.19830660624

文献信息

• MOUTH-COATING FEEL ENHANCER
  申请人：AJINOMOTO CO., INC.

  公开号：US20220000157A1

  公开（公告）日：2022-01-06

  Mouth-coating feel enhancers containing a heated substance of the following (A) and/or a heated substance of the following (B), or at least one compound selected from compound group (C) described in the present specification: (A) (A1) a compound represented by the formula (I): wherein each symbol is as defined in the present specification, and (A2) at least one selected from the group consisting of an aliphatic aldehyde having 3 to 14 carbon atoms, an aromatic aldehyde having 7 to 12 carbon atoms, an aliphatic alcohol having 3 to 12 carbon atoms, and a substance that produces at least one of these compounds by heating (B) at least one compound selected from the group consisting of β-caryophyllene and a β-caryophyllene analogous compound are effective as mouth-coating feel enhancers and coffee-roasting sensation enhancers.
• New Carbonyl Compounds in the High-Boiling Fraction of Lavender Oil. 2nd Communication
  作者：Roman Kaiser、Dietmar Lamparsky

  DOI：10.1002/hlca.19830660624

  日期：1983.9.21

  In addition to the sesquiterpenoid compounds reported in [1] the in-depth analysis of lavender oil also led to the identification of new constituents with caryophyllane (1–6), cedrane (7 and 8) and other skeletons (9–21). Spectroscopic properties as well as partial syntheses of these compounds are discussed.

  除了在[1]中报道的倍半萜类化合物外，对薰衣草油的深入分析还导致鉴定出了石竹素（1 – 6），雪松（7和8）和其他骨架（9 – 21）的新成分。讨论了这些化合物的光谱性质以及部分合成。