Exploring the Cytotoxic Activity of Dillenia serrata Thunb. Leaf Extracts: An In Vitro and In Silico Investigation.

Herlina Rasyid, Nunuk Hariani Soekamto, Bulkis Musa, Syadza Firdausiah, Siswanto Siswanto, Arniati Labanni, Artania A T Suma, Nur Hilal A Syahrir, Harno Dwi Pranowo, Risnita Vicky Listyarini, Bahrun Bahrun, Kadek Susi Badrawati, Mohammad Taufik Yusuf
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Abstract

Objective: Dillenia serrata Thunb. an endemic plant from Sulawesi Island, has been used by the local community as medicine for some diseases. However, studies related to these plants are still limited to several diseases. This study intends to investigate the cytotoxic activity of Dillenia serrata Thunb. leaves extract as an anticancer.

Methods: This study was preceded by gradual maceration and then subjected to phytochemical test to evaluate the contain of secondary metabolites such as alkaloid, flavonoid, tannin, steroid, terpenoid, and saponin, toxicity assay by BSLT method, cytotoxicity test against HeLa cell lines, further compound identification using GC-MS analysis and in silico analysis.

Results: The phytochemical tests demonstrated the presence of tannins, steroids, alkaloids, flavonoids, and saponins. The toxicity test indicated that all three extracts were toxic for Artemia salina L. as the premier test before the cytotoxicity test using HeLa cell lines. The LC50 values for the n-hexane, ethyl acetate, and methanol extracts were 58.27±6.15, 11.06±1.70, and 9.30±1.13 μg/mL, respectively. After evaluating the extracts' cytotoxicity activity, the ethyl acetate extract has the strongest activity with 91.08±0.23 μg/mL, then this extract was further identified using GC-MS analysis and reveals 51 chemicals which is Phytol as the main components in the extract with %area about 25.64%. Molecular docking analysis of Phytol against Epidermal Growth Factor Receptor (EGFR) showed a good binding energy of around -5.08 kcal/mol. The molecular dynamics simulation supports this result.

Conclusion: All extracts demonstrated intense toxicity levels. Out of all the extracts, ethyl acetate extract exhibited the strongest cytotoxic properties to HeLa cell lines with IC50 value 91.08±0.23 μg/mL. Ethyl acetate extract of D. serrata T. contains Phytol compounds which have a quite good affinity to the EGFR.  According to this study, ethyl acetate extract has the potential to be used as an alternative to anticancer medication.

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刺刺莲的细胞毒活性研究。叶提取物:体外和计算机研究。
目的Dillenia serrata Thunb.是苏拉威西岛的一种特有植物,一直被当地社区用作治疗某些疾病的药物。然而,与这些植物有关的研究仍局限于几种疾病。本研究旨在调查 Dillenia serrata Thunb.叶提取物的抗癌细胞毒性活性:本研究首先进行了渐进浸渍,然后进行了植物化学测试,以评估生物碱、黄酮、单宁、甾体、萜类和皂甙等次生代谢物的含量;采用 BSLT 法进行了毒性检测;对 HeLa 细胞系进行了细胞毒性检测;利用 GC-MS 分析和硅学分析进一步鉴定了化合物:植物化学测试表明了鞣质、类固醇、生物碱、黄酮类化合物和皂苷的存在。毒性测试表明,在使用 HeLa 细胞系进行细胞毒性测试之前的首要测试中,所有三种提取物都对盐鲫具有毒性。正己烷、乙酸乙酯和甲醇提取物的 LC50 值分别为 58.27±6.15、11.06±1.70 和 9.30±1.13 μg/mL。在对提取物的细胞毒活性进行评价后,乙酸乙酯提取物的细胞毒活性最强,为 91.08±0.23 μg/mL,然后利用气相色谱-质谱(GC-MS)分析对该提取物进行了进一步鉴定,结果显示该提取物的主要成分为 51 种化学物质,其中植物醇占 25.64%。植物醇与表皮生长因子受体(EGFR)的分子对接分析表明,其结合能约为 -5.08 kcal/mol。分子动力学模拟支持这一结果:所有提取物都显示出强烈的毒性。在所有提取物中,乙酸乙酯提取物对 HeLa 细胞株的细胞毒性最强,IC50 值为 91.08±0.23 μg/mL。D. serrata T.的乙酸乙酯提取物含有植物醇化合物,与表皮生长因子受体有很好的亲和性。 根据这项研究,乙酸乙酯提取物具有替代抗癌药物的潜力。
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来源期刊
CiteScore
2.80
自引率
0.00%
发文量
779
审稿时长
3 months
期刊介绍: Cancer is a very complex disease. While many aspects of carcinoge-nesis and oncogenesis are known, cancer control and prevention at the community level is however still in its infancy. Much more work needs to be done and many more steps need to be taken before effective strategies are developed. The multidisciplinary approaches and efforts to understand and control cancer in an effective and efficient manner, require highly trained scientists in all branches of the cancer sciences, from cellular and molecular aspects to patient care and palliation. The Asia Pacific Organization for Cancer Prevention (APOCP) and its official publication, the Asia Pacific Journal of Cancer Prevention (APJCP), have served the community of cancer scientists very well and intends to continue to serve in this capacity to the best of its abilities. One of the objectives of the APOCP is to provide all relevant and current scientific information on the whole spectrum of cancer sciences. They aim to do this by providing a forum for communication and propagation of original and innovative research findings that have relevance to understanding the etiology, progression, treatment, and survival of patients, through their journal. The APJCP with its distinguished, diverse, and Asia-wide team of editors, reviewers, and readers, ensure the highest standards of research communication within the cancer sciences community across Asia as well as globally. The APJCP publishes original research results under the following categories: -Epidemiology, detection and screening. -Cellular research and bio-markers. -Identification of bio-targets and agents with novel mechanisms of action. -Optimal clinical use of existing anti-cancer agents, including combination therapies. -Radiation and surgery. -Palliative care. -Patient adherence, quality of life, satisfaction. -Health economic evaluations.
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