Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential
The biological properties of plant oils are improved by their conversion to nanoemulsions (NEs). This study evaluated the antimicrobial, antioxidant, and anti-hemolytic efficacy of coconut and salad rocket oils and their NEs. The result of the gas chromatography-mass spectroscopy analysis of the oil...
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| Format: | Article |
| Language: | English |
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North Carolina State University
2023-01-01
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| Series: | BioResources |
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| Online Access: | https://ojs.cnr.ncsu.edu/index.php/BRJ/article/view/22171 |
| _version_ | 1797794784005324800 |
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| author | Husam Qanash Khulud Alotaibi Abdu Aldarhami Abdulrahman S. Bazaid Magdah Ganash Nizar H. Saeedi Tarek M. Abdel Ghany |
| author_facet | Husam Qanash Khulud Alotaibi Abdu Aldarhami Abdulrahman S. Bazaid Magdah Ganash Nizar H. Saeedi Tarek M. Abdel Ghany |
| author_sort | Husam Qanash |
| collection | DOAJ |
| description | The biological properties of plant oils are improved by their conversion to nanoemulsions (NEs). This study evaluated the antimicrobial, antioxidant, and anti-hemolytic efficacy of coconut and salad rocket oils and their NEs. The result of the gas chromatography-mass spectroscopy analysis of the oils showed varied constituents such as palmitic acid, trimethylsilyl ester; 2,3-bis(acetyloxy)propyl laurate in salad rocket oil, 2-lauro-1,3-didecoin, n-butyl laurate; laurin, tri-; laurin in coconut oil. NEs diameter of salad rocket and coconut oils was 24.6 and 29.2 nm, respectively. More inhibitory activity of NEs compared with non-NEs form against Bacillus cereus, Staphylococcus aureus, Escherichia coli, Salmonella typhi, Candida albicans, and Aspergillus flavus was detected. Coconut oil and its NEs caused 14.3% (anti-hemolysis 85.7%) and 22% hemolysis (anti-hemolysis 78%), respectively. Salad rocket oil and its NEs caused hemolysis 3.4% and 20.9%, respectively at 1000 µg/mL. Antioxidant activity of salad rocket and coconut oil reflected more IC50 (39.3 and 109.4 µg/mL) than its NEs (35.8 and 80.5 µg/mL), respectively. Molecular docking of trimethylsilyl ester and 2-lauro-1,3-didecoin against S. aureus (PDB=7BGE) and C. albicans protein (PDB=3DRA) revealed optimal binding mode that had the most energy interaction with the binding sites. |
| first_indexed | 2024-03-13T03:08:05Z |
| format | Article |
| id | doaj.art-9d881fbf0d1b4654b184d5c5bf4ee7a4 |
| institution | Directory Open Access Journal |
| issn | 1930-2126 |
| language | English |
| last_indexed | 2024-03-13T03:08:05Z |
| publishDate | 2023-01-01 |
| publisher | North Carolina State University |
| record_format | Article |
| series | BioResources |
| spelling | doaj.art-9d881fbf0d1b4654b184d5c5bf4ee7a42023-06-26T18:46:12ZengNorth Carolina State UniversityBioResources1930-21262023-01-0118115541576173Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial PotentialHusam Qanash0Khulud Alotaibi1Abdu Aldarhami2Abdulrahman S. Bazaid3Magdah Ganash4Nizar H. Saeedi5Tarek M. Abdel Ghany6Department of Medical Laboratory Science, College of Applied Medical Sciences, Molecular Diagnostics and Personalized Therapeutics Unit, University of Ha’ilBiology Department, Faculty of Science, Jazan UniversityDepartment of Medical Microbiology, Qunfudah Faculty of Medicine, Umm Al-Qura UniversityDepartment of Medical Laboratory Science, College of Applied Medical Sciences, University of Ha’ilBiology Department, Faculty of Science, King Abdulaziz UniversityDepartment of Medical Laboratory Technology, Faculty of Applied Medical Sciences, University of TabukBotany and Microbiology Department, Faculty of Science, Al-Azhar UniversityThe biological properties of plant oils are improved by their conversion to nanoemulsions (NEs). This study evaluated the antimicrobial, antioxidant, and anti-hemolytic efficacy of coconut and salad rocket oils and their NEs. The result of the gas chromatography-mass spectroscopy analysis of the oils showed varied constituents such as palmitic acid, trimethylsilyl ester; 2,3-bis(acetyloxy)propyl laurate in salad rocket oil, 2-lauro-1,3-didecoin, n-butyl laurate; laurin, tri-; laurin in coconut oil. NEs diameter of salad rocket and coconut oils was 24.6 and 29.2 nm, respectively. More inhibitory activity of NEs compared with non-NEs form against Bacillus cereus, Staphylococcus aureus, Escherichia coli, Salmonella typhi, Candida albicans, and Aspergillus flavus was detected. Coconut oil and its NEs caused 14.3% (anti-hemolysis 85.7%) and 22% hemolysis (anti-hemolysis 78%), respectively. Salad rocket oil and its NEs caused hemolysis 3.4% and 20.9%, respectively at 1000 µg/mL. Antioxidant activity of salad rocket and coconut oil reflected more IC50 (39.3 and 109.4 µg/mL) than its NEs (35.8 and 80.5 µg/mL), respectively. Molecular docking of trimethylsilyl ester and 2-lauro-1,3-didecoin against S. aureus (PDB=7BGE) and C. albicans protein (PDB=3DRA) revealed optimal binding mode that had the most energy interaction with the binding sites.https://ojs.cnr.ncsu.edu/index.php/BRJ/article/view/22171antimicrobialantioxidantanti-hemolyticnanoemulsionssalad rocketcoconut |
| spellingShingle | Husam Qanash Khulud Alotaibi Abdu Aldarhami Abdulrahman S. Bazaid Magdah Ganash Nizar H. Saeedi Tarek M. Abdel Ghany Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential BioResources antimicrobial antioxidant anti-hemolytic nanoemulsions salad rocket coconut |
| title | Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential |
| title_full | Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential |
| title_fullStr | Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential |
| title_full_unstemmed | Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential |
| title_short | Effectiveness of Oil-based Nanoemulsions with Molecular Docking of its Antimicrobial Potential |
| title_sort | effectiveness of oil based nanoemulsions with molecular docking of its antimicrobial potential |
| topic | antimicrobial antioxidant anti-hemolytic nanoemulsions salad rocket coconut |
| url | https://ojs.cnr.ncsu.edu/index.php/BRJ/article/view/22171 |
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