butyrolactone-i has been researched along with benzophenone* in 1 studies
1 other study(ies) available for butyrolactone-i and benzophenone
| Article | Year |
|---|---|
X-ray, structural assignment and molecular docking study of dihydrogeodin from Aspergillus Terreus TM8.
A re-cultivation of the thermophilic fungus Aspergillus terreus TM8, and working up of its extract afforded the dichloro-benzophenone derivative, dihydrogeodin (1) in addition to the butyrolactones I (2), V (3) and VI (4). A literature surveying revealed one recent structural assignment trial for dihydrogeodin (1), however, with some inaccuracies. We report herein a full assignment of dihydrogeodin (1) using extensive study of 1D, 2D NMR and ESI HR mass data. For the first time as well, we report the planar structure of 1 using X-ray crystallography. Docking and molecular dynamic simulation of dihydrogeodin (1) on the isomerase cyclophilin A has revealed its significant potential activity as an antiviral and immunosuppressive agent. Topics: 4-Butyrolactone; Antiviral Agents; Aspergillus; Benzofurans; Benzophenones; Crystallography, X-Ray; Cyclophilin A; Immunosuppressive Agents; Molecular Docking Simulation; Molecular Dynamics Simulation; Molecular Structure | 2019 |