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Filicinic Acid Based Meroterpenoids with Anti-Epstein–Barr Virus Activities from Hypericum japonicum

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acs.figshare.com2023-06-01 更新2025-03-22 收录
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https://acs.figshare.com/articles/dataset/Filicinic_Acid_Based_Meroterpenoids_with_Anti_Epstein_Barr_Virus_Activities_from_i_Hypericum_japonicum_i_/3201781/1
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Seven filicinic acid–based meroterpenoids (1–7), possessing 6/6/11, 6/6/7/5, or 6/6/10 ring systems, were isolated from Hypericum japonicum. All of them have novel skeletons with the incorporation of sesquiterpenoid moieties to an acylated filicinic acid. Compounds 2a and 4 exhibited significant efficacy on anti-Epstein–Barr virus, with EC50 values of 0.57 and 0.49 μM, respectively. Furthermore, compounds 2a and 4 were well accommodated to the binding pocket of 2GV9 predicted by the molecular docking.

从日本金丝桃(Hypericum japonicum)中分离出七种基于菲尼酸(filicinic acid)的甲氧基萜类化合物(1-7),它们分别具有6/6/11、6/6/7/5或6/6/10的环状结构系统。这些化合物均拥有新颖的骨架结构,通过将倍半萜单元并入酰化菲尼酸中实现。其中,化合物2a和4在抗爱泼斯坦-巴尔病毒(Epstein–Barr virus)方面表现出显著的活性,其半数有效浓度(EC50)分别为0.57和0.49微摩尔。此外,2a和4化合物与通过分子对接预测的2GV9结合口袋具有良好的适配性。
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