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- Title
Monomethyl Suberate Screening for Antifungal Activity, Molecular Docking and Drug-Like Properties.
- Authors
Antypenko, Lyudmyla; Meyer, Fatuma; Sadykova, Zhanar; Garbe, Leif-Alexander; Steffens, Karl
- Abstract
Antifungal activity of suberic acid monomethyl ester (monomethyl suberate) was investigated in a growth inhibition assay comprising of 11 different fungi and 3 Phytophthora oomycetes strains relevant in agriculture. In comparison to standard antifungal hymexazol, monomethyl suberate showed moderate antifungal effects at a concentration range of 100-;300 μg/mL. Alternaria alternata, Fusarium equiseti, Fusarium fujikuroi and Phytophtora infestans GL-1 were the most sensitive fungi showing inhibition rates up to 100%. Physico-chemical descriptors of monomethyl suberate revealed its low toxicity profile. Molecular docking analysis comprising several known antifungal targets points to the N-myristoyltransferase as the most probable site of interaction.
- Subjects
CHEMICAL derivatives; ANTIFUNGAL agents; MOLECULAR docking; ALTERNARIA alternata; GAS chromatography
- Publication
Acta Chimica Slovenica, 2018, Vol 65, Issue 4, p836
- ISSN
1318-0207
- Publication type
Article
- DOI
10.17344/acsi.2018.4440