ol6b00906_si_003.pdb (1.25 MB)
Filicinic Acid Based Meroterpenoids with Anti-Epstein–Barr Virus Activities from Hypericum japonicum
dataset
posted on 2016-04-26, 18:03 authored by Linzhen Hu, Yu Zhang, Hucheng Zhu, Junjun Liu, Hua Li, Xiao-Nian Li, Weiguang Sun, Junfen Zeng, Yongbo Xue, Yonghui ZhangSeven 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.