Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking
Exposure to UV/infrared (IR) radiation is the main extrinsic factor that changes skin morphology and affects the increase in reactive oxygen species (ROS) in skin aging. Ten varieties of andaliman (<i>Zanthoxylum acanthopodium</i> DC.) fruit are presumed to have skin anti-aging compounds...
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MDPI AG
2023-03-01
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| Series: | Life |
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| Online Access: | https://www.mdpi.com/2075-1729/13/3/754 |
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| author | Endang Kintamani Irmanida Batubara Cecep Kusmana Tatang Tiryana Edi Mirmanto Shadila F. Asoka |
| author_facet | Endang Kintamani Irmanida Batubara Cecep Kusmana Tatang Tiryana Edi Mirmanto Shadila F. Asoka |
| author_sort | Endang Kintamani |
| collection | DOAJ |
| description | Exposure to UV/infrared (IR) radiation is the main extrinsic factor that changes skin morphology and affects the increase in reactive oxygen species (ROS) in skin aging. Ten varieties of andaliman (<i>Zanthoxylum acanthopodium</i> DC.) fruit are presumed to have skin anti-aging compounds via an enzyme-inhibition mechanism. This study aims to compare ten essential oils (EOs) of andaliman fruit varieties, group them according to their varieties, and obtain the chemical components that can be used as potential skin anti-aging agents using molecular docking. EOs were isolated by hydrodistillation, and the determination of the chemical compounds was performed using gas chromatography-mass spectrometry (GC-MS). Using the Orange data mining software, a heatmap was used for grouping and showing the abundance of the compounds of ten varieties. Finally, molecular docking was conducted using the software AutoDockTools 1.5.7. There were 97 chemical components in the ten EOs of andaliman fruit varieties, with the main chemical components being geranyl acetate (29.87%) and D-limonene (26.49%), and they were grouped into three clusters. The chemical components that are prospective candidates as skin anti-aging agents are geranyl acetate and D-limonene, found in abundance in the Sihalus variety of andaliman fruit. These can be developed for applications in the pharmaceutical industry. |
| first_indexed | 2024-03-11T06:17:19Z |
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| issn | 2075-1729 |
| language | English |
| last_indexed | 2024-03-11T06:17:19Z |
| publishDate | 2023-03-01 |
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| record_format | Article |
| series | Life |
| spelling | doaj.art-7a5f1741ecc740969f1cd1f7751f38b92023-11-17T12:11:54ZengMDPI AGLife2075-17292023-03-0113375410.3390/life13030754Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular DockingEndang Kintamani0Irmanida Batubara1Cecep Kusmana2Tatang Tiryana3Edi Mirmanto4Shadila F. Asoka5Department of Silviculture, Faculty of Forestry and Environment, IPB University, Bogor 16680, IndonesiaDepartment of Chemistry, Faculty of Mathematics and Natural Sciences, IPB Univeristy, Bogor 16680, IndonesiaDepartment of Silviculture, Faculty of Forestry and Environment, IPB University, Bogor 16680, IndonesiaDepartment of Forest Management, Faculty of Forestry and Environment, IPB University, Bogor 16680, IndonesiaResearch Center for Ecology and Ethnobiology, National Research and Innovation Agency, Cibinong 16911, IndonesiaDepartment of Chemistry, Faculty of Mathematics and Natural Sciences, IPB Univeristy, Bogor 16680, IndonesiaExposure to UV/infrared (IR) radiation is the main extrinsic factor that changes skin morphology and affects the increase in reactive oxygen species (ROS) in skin aging. Ten varieties of andaliman (<i>Zanthoxylum acanthopodium</i> DC.) fruit are presumed to have skin anti-aging compounds via an enzyme-inhibition mechanism. This study aims to compare ten essential oils (EOs) of andaliman fruit varieties, group them according to their varieties, and obtain the chemical components that can be used as potential skin anti-aging agents using molecular docking. EOs were isolated by hydrodistillation, and the determination of the chemical compounds was performed using gas chromatography-mass spectrometry (GC-MS). Using the Orange data mining software, a heatmap was used for grouping and showing the abundance of the compounds of ten varieties. Finally, molecular docking was conducted using the software AutoDockTools 1.5.7. There were 97 chemical components in the ten EOs of andaliman fruit varieties, with the main chemical components being geranyl acetate (29.87%) and D-limonene (26.49%), and they were grouped into three clusters. The chemical components that are prospective candidates as skin anti-aging agents are geranyl acetate and D-limonene, found in abundance in the Sihalus variety of andaliman fruit. These can be developed for applications in the pharmaceutical industry.https://www.mdpi.com/2075-1729/13/3/754D-limoneneGC-MSgeranyl acetaterejuvenationSihalus variety |
| spellingShingle | Endang Kintamani Irmanida Batubara Cecep Kusmana Tatang Tiryana Edi Mirmanto Shadila F. Asoka Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking Life D-limonene GC-MS geranyl acetate rejuvenation Sihalus variety |
| title | Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking |
| title_full | Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking |
| title_fullStr | Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking |
| title_full_unstemmed | Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking |
| title_short | Essential Oil Compounds of Andaliman (<i>Zanthoxylum acanthopodium</i> DC.) Fruit Varieties and Their Utilization as Skin Anti-Aging Using Molecular Docking |
| title_sort | essential oil compounds of andaliman i zanthoxylum acanthopodium i dc fruit varieties and their utilization as skin anti aging using molecular docking |
| topic | D-limonene GC-MS geranyl acetate rejuvenation Sihalus variety |
| url | https://www.mdpi.com/2075-1729/13/3/754 |
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