4-epicryptomeridiol | 108006-39-9

• 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: 4-epicryptomeridiol
• 英文别名: (1S,4aR,7R,8aR)-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-ol
• CAS: 108006-39-9
• 化学式: C₁₅H₂₈O₂
• 分子量: 240.386
• InChiKey: LKKDASYGWYYFIK-GBOPCIDUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  beta-桉叶醇 在 臭氧 、 溶剂黄146 、 锌 作用下， 以 乙醚 为溶剂， 反应 2.17h， 生成 4-epicryptomeridiol
  参考文献：
  名称：

  Structures and Spasmolytic Activities of Derivatives from Sesquiterpenes of Alpinia speciosa and Alpinia japonica.

  摘要：

  通过马格努斯法测试发现，从白山药和白山药中分离出的倍半萜及其衍生物可抑制组胺或氯化钡引起的切除豚鼠回肠收缩。这些提取物所含的主要解痉成分是倍半萜、β-桉叶油醇、橙花叔醇、环氧化葎草烯 II 和 4α-羟基二氢豨莶草醚。讨论了倍半萜及其衍生物的化学结构与它们的解痉活性之间的关系。

  DOI：

  10.1248/cpb.44.1603

文献信息

• Intramolecular Photocycloaddition of 2-Cycloalkenyl-1,3-dioxin-4-one. Stereoselective Synthesis of cis-Eudesmane-4,11-diols
  作者：Toshihide Hatsui、Ka Li、Akira Mori、Hitoshi Takeshita

  DOI：10.3987/com-00-s(i)65

  日期：——

  Two isomeric eudesmane-4,11-diols having a cis-decalin skeleton were synthesized via intramolecular photocycloaddition of 6-methyl-2- (4-methyl-3-cyclohexen-1-yl)- 1,3-dioxin-4-one, Comparison of their NMR spectra with the natural diol, isolated from the Pakistanii medicinal plant, Pluchea arguta (Compositae), indicated that it should be a trans-eudesmanoid.
• Structures and Spasmolytic Activities of Derivatives from Sesquiterpenes of Alpinia speciosa and Alpinia japonica.
  作者：Makoto MORITA、Hiroshi NAKANISHI、Hiroshi MORITA、Susumu MIHASHI、Hideji ITOKAWA

  DOI：10.1248/cpb.44.1603

  日期：——

  Sesquiterpenes isolated from Alpinia speciosa and Alpinia japonica, and their derivatives were found to inhibit histamine- or barium chloride-induced contraction of excised guinea pig ileum when tested by the Magnus method. Major spasmolytic principles contained in those extracts were the sesquiterpenes, β-eudesmol, nerolidol, humulene epoxide II and 4α-hydroxydihydroagarofuran. Relationships between the chemical structures of the sesquiterpenes and their derivatives, and their spasmolytic activities were discussed.

  通过马格努斯法测试发现，从白山药和白山药中分离出的倍半萜及其衍生物可抑制组胺或氯化钡引起的切除豚鼠回肠收缩。这些提取物所含的主要解痉成分是倍半萜、β-桉叶油醇、橙花叔醇、环氧化葎草烯 II 和 4α-羟基二氢豨莶草醚。讨论了倍半萜及其衍生物的化学结构与它们的解痉活性之间的关系。