Sciences of Phytochemistry
Open Access Journal

Sciences of Phytochemistry

p-ISSN: 2962-5793
e-ISSN: 2962-553X
DOI: 10.58920/sciphy
sciphy@etflin.com (Managing Editor)
PharmacognosyPhytochemistryPhytoinformaticsComputational phytochemistryIn-silico studiesPharmacological activitiesToxicologyHerbal formulationsMolecular dockingMolecular Dynamics SimulationNetwork pharmacologyToxicological studies

Volume 2 Issue 1

Showing 12 Articles

MINI REVIEW

  • Could Ginger Extract Be a Therapeutic Drug for Migraine?
    mini review

    Could Ginger Extract Be a Therapeutic Drug for Migraine?

    Ahmed Abd El-Moniem Amer

    Migraine is a common neurological disorder that may be accompanied by vascular disturbances, Migraine is one of the most causes of disability worldwide. Zingiber officinale is a medicinal herb that has an analgesic effect on many disorders such as headaches, migraine, muscle tension, stomach spasm, and dysmenorrhea. Also, ginger has many pharmacological actions used to treat and prevent various common symptoms and diseases. This review aims to evaluate the potential of ginger to treat or prevent migraine episodes. Especially nowadays, patients prefer herbal and complementary medicine to avoid the hard side effects of chemical drugs. The author searched several databases including PubMed, Science Direct, Wiley Online, and Scopus through February 2023 for recent articles with good quality evaluating the potential of ginger to treat migraine patients. The author made investigations and Interpretations depending on the results of the authors' experiments in previous articles included in my review. It is suggested that the bioactive compounds in ginger have the potential to treat and prevent acute migraine episodes effectively and safely. The author recommends encouraging the manufacturing of different pharmaceutical dosage forms of ginger extract to be used worldwide in a safe way and to render a higher absorption rate, and pharmacological response.

    Sciences of Phytochemistry

    12 May 2023
    6 pages

OPINION

  • opinion

    Unlocking the Therapeutic Potential of Garcinia cowa Rox. in Diabetes Management

    Kalyani Pathak, Riya Saikia, Aparoop Das

    Garcinia cowa Rox. is a tropical fruit traditionally used in various parts of Asia for medicinal purposes. Recent research has indicated that it may have potential as an antidiabetic drug. Studies have shown that the extract from the fruit of G. cowa can lower blood glucose levels in diabetic rats. This effect is believed to be due to various bioactive compounds, including flavonoids and xanthones, which have demonstrated antidiabetic properties. In addition, fruit extract has also been found to improve lipid metabolism, often disrupted in individuals with diabetes. The extract has been shown to reduce levels of triglycerides, total cholesterol, and low-density lipoprotein cholesterol while increasing high-density lipoprotein cholesterol levels. Further studies are needed to explore the full potential of G. cowa as an antidiabetic drug, including clinical trials in humans. However, these initial findings suggest that this tropical fruit is a promising natural and effective treatment option for individuals with diabetes.

    Sciences of Phytochemistry

    10 Mar 2023
    3 pages

RESEARCH ARTICLE

  • Design and Screening of Tetracycline Antibiotics: An In Silico Approach
    research article

    Design and Screening of Tetracycline Antibiotics: An In Silico Approach

    Nahar Uddin Barbhuyan, Dubom Tayeng, Neelutpal Gogoi, Lima Patowary, Dipak Chetia, Malita Sarma Barthakur

    A prominent class of broad-spectrum antibiotics known as tetracycline works by inhibiting the synthesis of proteins, which prevents the development of bacteria. Tetracycline resistance is typically attributed to one or more of the following causes: ribosomal binding site mutations, acquisition of mobile genetic elements carrying tetracycline-specific resistance genes, and/or chromosomal mutations that increase the expression of intrinsic resistance mechanisms. In this research, our objective is to virtually plan and conduct in-silico experiments to find tetracycline derivatives with inhibitory capability against tetracycline resistance protein. The tetracycline derivatives were screened using the Data Warrior, Discovery Studio, PyRx, and Swiss ADME web tools. Initially, 19 tetracycline derivatives were primarily screened for ADME and toxicity study followed by docking study. Among the tetracycline derivatives, C1, C11, C12, C14, C16, and C17 were found to be the potential drug-like molecules with binding energies of -8.9 kcal/mol, -8.4 kcal/mol, -8.5 kcal/mol, -7.7 kcal/mol, -7.7 kcal/mol, -8.6 kcal/mol respectively. In particular, C1 was predicted to have a better binding affinity towards the target protein than the others.

    Sciences of Phytochemistry

    11 Feb 2023
    7 pages
  • Comparison of Blood Glucose Control Among Type 2 Diabetics Consuming Oral Antidiabetic Drug Versus Oral Antidiabetic Drug With Home Remedies
    research article

    Comparison of Blood Glucose Control Among Type 2 Diabetics Consuming Oral Antidiabetic Drug Versus Oral Antidiabetic Drug With Home Remedies

    Kavitha Karthik Pai, Neethu Mathews, Meenakshi Garg

    In this study, we aim to compare the blood glucose control, dietary habits, glycemic load, socio-demographic & lifestyle habits, and anthropometric indices among type 2 diabetics that are consuming oral antidiabetic drug alone versus oral antidiabetic drug with home remedies. A cross-sectional study was undertaken on 300 patients attending OPDs of the Department of Medicine, Kasturba Hospital, Manipal, India, and Goretti Hospital Kallianpura, Udupi, India. The data were subjected to statistical analysis with the SPSS 16 software and dietary analysis was performed with the DietCal software. Out of 300 samples, 127 (42.3%) consumed the antidiabetic drug along with home remedies while 173 (57.7%) participants consumed the antidiabetic drug alone without home remedies. There was no significant difference in glycemic parameters like FBS (0.577NS), PPBS (0.179 NS), HbA1C (0.413NS), and there is no significant difference in the mean glycemic load of the diet between participants of the 2 groups (0.653NS). Dietary habits, socio-demographics, lifestyle habits, and anthropometric indices among the 2 groups do not show a significant difference. Our study revealed the poor control of diet in both groups. Home remedies can give an added benefit if diet and lifestyle modification are followed. Diet and lifestyle modification are very important for glycemic control to prevent long-term complications.

    Sciences of Phytochemistry

    12 Jan 2023
    6 pages
  • Phytocompound Inhibitors of Caspase-3 as a Beta-Cell Apoptosis Treatment Development Option: An In Silico Approach
    research article

    Phytocompound Inhibitors of Caspase-3 as a Beta-Cell Apoptosis Treatment Development Option: An In Silico Approach

    Igbokwe Mariagoretti Chikodili, Ibe Ifeoma Chioma, Ilechukwu Augusta Ukamaka, Oju Theclar Nnenna, Okoye Delphine Ogechukwu, Ernest Eze Mmesoma, Ekeomodi Christabel Chikodi, Ejiofor InnocentMary IfedibaluChukwu

    The prevalence of Diabetes mellitus (DM) is continuously rising worldwide. Among its types, type I is characterized by the destruction of beta cells triggered by various mechanisms, including the activation of Caspase 3. Studies have demonstrated the crucial role of Caspase 3 in initiating the apoptosis of beta cells in DM. Our research aims to identify possible phytocompounds inhibitors of Caspase 3 using computational approach. We obtained 3D structures of Caspase 3 and 6511 phytocompounds from the Protein Data Bank and the African Natural Products Database, respectively. The phytocompounds were assessed for druglikeness properties, topological polar surface area, and preliminary toxicity using DataWarrior. The phytocompounds were subjected to molecular docking simulation (MDS) at Caspase 3 active site using AutoDock-Vina. The frontrunner phytocompounds obtained from the MDS were subjected to protease inhibition prediction on Molinspiration. The pharmacokinetics of the phytocompounds were assessed on SwissADME. The in-depth computational toxicity profile of the phytocompounds was evaluated on the pkCSM web. The binding interactions of the phytocompounds with Caspase 3 were assessed with Discovery Studio Visualizer and Maestro. Seventeen phytocompounds were found to have no violation of Lipinski's rule and had no toxicity based on the preliminary assessment, have better binding affinity and protease inhibitory prediction scores than the references, have optimistic bioactivity radar prediction and similar amino acids interaction, in comparison with the references. Further studies, which include in-vitro and in-vivo studies, will be carried out to validate the results of this study.

    Sciences of Phytochemistry

    9 Mar 2023
    17 pages
  • Inhibitory Effect of Herbal Compounds on the Oxygen-Insensitive NADPH Nitro Reductase Enzyme of Metronidazole-Resistant Helicobacter pylori
    research article

    Inhibitory Effect of Herbal Compounds on the Oxygen-Insensitive NADPH Nitro Reductase Enzyme of Metronidazole-Resistant Helicobacter pylori

    Mohammadreza Saeed, Anoosh Eghdami

    Helicobacter pylori is a significant risk factor for chronic gastritis, gastric ulcers, and gastric cancer. The purpose of this article is to investigate the potential impact of fifty herbal compounds derived from Ginger and Parsley plants, known for their antibacterial properties on the Oxygen-insensitive NADPH nitro reductase enzyme of metronidazole-resistant H. pylori. In the present study, the information on the structure of compounds, the H. pylori resistant to metronidazole enzyme, myristicin, and shogaol derivatives were obtained from databases such as ZINC15, RCSB (Protein Data Bank), and PubChem, respectively. Finally, molecular docking was performed with iGemdock2.1 and Molegro Virtual Docker. After molecular docking, four out of the fifty phytocompounds showed the lowest energy and the highest number of interactions with the amino acids at the binding sites. Among these four phytocompounds, the best phytocompound was N-Vanillyloctanamide derived from Ginger. Our molecular docking study suggests that ginger can be introduced as a potential candidate to inhibit the growth of H. pylori.

    Sciences of Phytochemistry

    28 May 2023
    11 pages
  • In Vitro and In Silico Evaluation of Brugmansia suaveolens' Ability to Treat Asthma
    research article

    In Vitro and In Silico Evaluation of Brugmansia suaveolens' Ability to Treat Asthma

    Shouvik Kumar Nandy, Shikha Thakur

    Asthma is a common chronic inflammatory disease of the airways. The airway epithelium produces bioactive cellular mediators that trigger the chronic inflammatory response. These mediators then attract and activate inflammatory cells in the airways of the lungs and release more biochemical mediators. With several benefits, such as a significant reduction in the cost and time of drug discovery as well as the use of laboratory animals, in silico studies have grown to be an important and simple method for examining various chemical compounds against various targets. One of the common herbs found in the local Himalayan area is Brugmansia sauveolens, known as Datura, which is a source of tropane alkaloids and asthma can be effectively managed with alkaloids. Using a Soxhlet extractor, the collected plant components were first extracted with petroleum ether (to remove fats) followed by methanol. Online technologies like PASS Online, Molinspiration, SEA, SWISS, and SLAP data were used for a variety of in silico predictions. After that, we tested the ability of Brugmansia extracts to reduce inflammation using an in vitro approach. Rat RBC membrane lyses were stabilized using the plant extract fractions. The outcomes were also compared with aspirin (a common anti-inflammatory drug). Bioinformatics techniques were used to detect structural activity. After investigating all the data It was shown that B. sauveolens had anti-asthmatic activity.

    Sciences of Phytochemistry

    1 Jun 2023
    10 pages
  • Pharmacognostic Study and Hepatoprotective Activity of the Methanolic Extract and Fractions of Leaves of Picralima nitida Apocyanaceae
    research article

    Pharmacognostic Study and Hepatoprotective Activity of the Methanolic Extract and Fractions of Leaves of Picralima nitida Apocyanaceae

    Akinlade Mary Ololade, Fredrick Chinedu Anowi, Ajaghaku Amara Anwuchaepe, Ejiofor InnocentMary IfedibaluChukwu

    Picralima nitida the only species in the genus Picralima belongs to the Apocyanaceae family. It is widely known for its medicinal purposes. The aim of the study was to investigate pharmacognostic parameters of the leaf and evaluate the hepatoprotective activity against carbon tetrachloride induced hepatotoxicity using Swiss Albino mice. The physicochemical evaluation indicated 11.75% moisture content, 8.50% total ash, 9.50% acid insoluble ash, 4.00% water soluble ash, 13.75% alcohol extractive value and 11.00% water extractive value. Macroscopic analysis on the fresh leaves revealed an odourless green plant with bitter taste. Microscopic examination indicated the presence of calcium oxalate crystals, starch grains, epidermal cells, xylem, parenchyma cells, paracytic stomata and palisade tissue. Chemomicroscopic evaluation indicated the presence of oxalate crystals, starch grains, lignified tissues, tannins, cellulose, protein and oil. The acute toxicity result revealed that P. nitida had no adverse effect in Swiss Albino mice. The ethyl acetate fraction had hepatoprotective ability on liver enzymes (alanine transaminase, aspartate aminotransferase, alkaline phosphatase) and can produce the same result as ascorbic acid (standard).

    Sciences of Phytochemistry

    29 May 2023
    11 pages

REVIEW

  • Ethnobotany and Phytopharmacology of Avena sativa: A Qualitative Review
    review

    Ethnobotany and Phytopharmacology of Avena sativa: A Qualitative Review

    Shuby Kumari, Sheikh Rezzak Ali, Obaidur Rahman, Amit Kumar, Hans Raj Bhat, Surajit Kumar Ghosh, Anshul Shakya

    Among all cereals, oat is considered to be one of the goods consumed in functional grain, nutraceutical, and pharmaceutical components. The review article aims to explore plant profile, phytochemical constituents present in different parts, and potential therapeutic agent which prevents people from different diseases with their respective mechanism of action it also includes toxicity studies, dosage form, marketed formulation, and industrial application. The information on Avena sativa is collected from the different databases available in Science Direct, PubMed, Scopus, and Google Scholar to search for research papers for literature and data. Reviewed information suggests that the A. Sativa is a good source of a range of phytochemicals including lignans, saponin, anthocyanidins, and avenanthramides, which might be directly and/or indirectly linked with beneficial nutraceutical and/or pharmacological effect (s). The review states, that A. sativa is a promising candidate as a functional and/or non-functional food because of various phytoconstituents. The clinical report has described that the utilization of oats can provide several health benefits. However, systematic rational investigations for such indications and safety profiles are yet to be explored.

    Sciences of Phytochemistry

    26 Apr 2023
    14 pages
  • review

    Prolonged Space Flight: Adverse Health Effects and Treatment Options With Medicinal Plants and Natural Products

    Nayana Bhuyan, Shatabdi Ghose, Smitashikha Bhattacharya, Tapash Chakraborty

    Exposure to zero gravity causes many physiological changes which may result to affect the health of people involved in space travel. The current review summarizes current knowledge on the start and progression of space motion sickness, bone loss, muscle loss, cardiovascular disorders, respiratory problems, and neuronal and hormonal problems. Around 70% of astronauts suffer from space adaption syndrome, fluid changes, and head motions. It has also been suggested that otolith asymmetries and Coriolis cross-coupling stimulation are the main causes of space motion sickness. The findings reveal that space flight directly affects the body's normal functioning. Despite an intense training routine, a study of historical data from piloted flights discovered that slow degradation of bone and muscle tissue, along with fluid losses, can eventually lead to kidney stones, musculoskeletal problems, bone fractures, and even problems with other organs of the body. Due to such problems focus is given to curing these problems associated with space travel. Medicines that are used in space and medicinal plants like Spirulina, and Ginseng that are of use for the treatment of these problems associated with space travel are discussed along with the treatment options available for such problems in space and the cautions that must be followed. Also, the herbal medication that can be used in outer space is taken into account. The findings of this study state the necessary precaution that needs to be taken by astronauts in outer space and also provides information for future research to be done on solving these problems.

    Sciences of Phytochemistry

    24 May 2023
    11 pages
  • An Overview of the Historical Context for Jamun's Diverse Medicinal Properties
    review

    An Overview of the Historical Context for Jamun's Diverse Medicinal Properties

    Tanmay Sanjay Kamble, Kshitij Suhas Shirke, Kiran Babu Uppar, Sonal Balasaheb Bangar, Namrata Santosh Naware, Shreya Sakharam Ambatkar, Mukesh Patil, Ashish Jain

    Syzygium cumini, also known as Jamun, Jambul, or Indian blackberry, is a species of tree native to the Indian subcontinent. A comprehensive literature review shows that Jamun can be considered one of the most versatile herbal medicines with antidiabetic, antioxidant, antiinflammatory, and other properties. This review aims to investigate and understand the previous research on Jamun, including its pharmacognosy and pharmacological history, to confirm its potential to treat a variety of illnesses. The study also examined the current pharmaceutical formulations available in the market to understand the potential for developing medications from the components of Jamun. To comprehend the available studies, the analytical backdrop is also reviewed. Despite being the focus of many research studies, there are still many unanswered questions regarding Jamun. Therefore, the best formulations or products may be produced in these sectors, possibly through nutraceuticals, to support improved pharmacological aspects or health promotion. This review will help identify unexplored areas where specific tasks related to Jamun can be done.

    Sciences of Phytochemistry

    19 Apr 2023
    12 pages
  • Lawsonia inermis Linn: A Breakthrough in Cosmeceuticals
    review

    Lawsonia inermis Linn: A Breakthrough in Cosmeceuticals

    Siuli Sen, Malita Sarma Borthakur, Dipak Chetia

    Herbal cosmetics are formulated using different cosmetic ingredients to form the base in which one or more herbal ingredients are used to cure various skin ailments. The name suggests that herbal cosmetics are natural and free from all the harmful synthetic chemicals that otherwise may be toxic to the skin. Compared to other beauty products, natural cosmetics are safe to use. Cosmeceuticals are cosmetic-pharmaceutical hybrid products intended to improve the health and beauty of the skin by providing a specific result. There are numerous herbs available naturally that have different uses in cosmetic preparations for skincare, hair care, and as antioxidants. The current study included a review and authentication of the various aspects of the plant Lawsonia inermis. L. inermis, commonly known as henna, has been cultivated for thousands of years for its leaves, which contain a natural dye molecule called lawsone that is commonly used to dye hair, skin, and fabrics. Henna has a long history of use in traditional medicine, where it has been used to treat a variety of ailments. In addition to its medicinal and cosmetic uses, henna has cultural and religious significance in many parts of the world and is commonly used to decorate the skin for weddings, festivals, and other special occasions. Because of these  properties, the L. inermis plant can be used as a medicine against a wide range of pathogenic organisms and diseases. This review covers the phytochemistry, pharmacological properties, and traditional uses of the plant.

    Sciences of Phytochemistry

    31 May 2023
    22 pages

Journal Key Facts

Publishing Fee (APC)

No Charge

Open Access License

CC BY 4.0

Language

English

Abstracting & Indexing
CASDOAJ

Overview

Sciences of Phytochemistry (Sci. Phytochem.) is an international, peer-reviewed journal published by ETFLIN, dedicated to advancing research in all aspects of phytochemistry and plant-derived bioactive compounds. The journal provides a platform for the dissemination of original research, reviews, and scientific communications that explore the chemistry, biological activities, and applications of natural products derived from plants. We welcome contributions that deepen the understanding of the chemical diversity of plants and their potential in pharmaceuticals, nutraceuticals, agriculture, cosmetics, and environmental sustainability.

Current Issue

Latest Articles

Recently published research articles, review papers, and technical notes from the current volume of the journal.

  • research article

    Metabolite Profiling of Balinese Grape (Vitis vinifera L. Var. Alphonso Lavallee) Kombucha: GC-MS Analysis

    Ida Ayu Manik Damayanti, Nadya Treesna Wulansari, Ni Wayan Kesari Dharmapatni, Ni Wayan Sukma Antari

    Balinese grape (Vitis vinifera L. var. Alphonso Lavallee) is a local grape variety containing various phytochemical constituents. Fermentation into kombucha using a symbiotic culture of bacteria and yeast (SCOBY) may alter the chemical composition of the substrate through microbial metabolic activity. This study aimed to characterize the metabolite profile of Balinese grape kombucha using Gas Chromatography-Mass Spectrometry (GC-MS). GC-MS analysis detected several chemical constituents, including fatty acid esters, alkaloids, and terpenoid hydrocarbons. The major compounds identified based on mass spectral library matching were 9-Octadecenoic acid methyl ester (E)-, acetic acid n-octadecyl ester, caffeine, and 2, 6, 10, 14, 18, 22-tetracosahexaene, 2, 6, 10, 15, 19, 23-hexamethyl-, (all-E)-. These results describe the metabolite profile detected in the fermented sample and indicate changes in chemical composition following kombucha fermentation. The findings provide preliminary information on the chemical constituents of Balinese grape kombucha and may serve as a basis for further studies involving comparative analyses with unfermented substrates and confirmation of compound identities using complementary analytical approaches.

    Sciences of Phytochemistry

    17 Jul 2026
    5 pages
  • research article

    Identification and Characterization of Volatile Compounds in Antidesma bunius (Buni) Fruit Kombucha During Fermentation

    Nadya Treesna Wulansari, Ni Wayan Kesari Dharmapatni, Ida Ayu Manik Damayanti, Ni Made Raningsih

    Buni fruit (Antidesma bunius) is a fruit commonly found in tropical countries such as Indonesia. This fruit has the potential to be developed into kombucha tea because it contains beneficial bioactive compounds. However, the use of buni fruit as kombucha tea remains very limited and has not been studied in depth. The objective of this study was to identify and characterize the volatile compounds in buni fruit kombucha using GC-MS. This study employed a descriptive experimental design to analyze the volatile compounds in buni fruit kombucha after 8 days of fermentation using GC-MS. Buni fruit kombucha fermented for 8 days produced a dark purple color. Based on the analysis of volatile compounds, buni fruit kombucha was identified as containing 30 volatile compounds. The dominant compounds were hexadecanoic acid methyl ester, hexadecanoic acid ethyl ester, 9-octadecenoic acid methyl ester, (E)-9-octadecenoic acid ethyl ester, octadecanoic acid ethyl ester, eicosanoic acid ester, and docosahexaenoic acid methyl ester, which are classified as fatty acid esters and lipids. Additionally, the identified alcohol compounds are patchouli alcohol and 13-tetradecen-11-yn-1-ol. Buni fruit kombucha tea undergoes chemical transformations characterized by the formation of volatile compounds such as esters, alcohols, and fatty acid derivatives as a result of microbial metabolic activity. The profile of the resulting compounds highlights the important role of biotransformation during fermentation in shaping the sensory characteristics and bioactive potential of kombucha tea.

    Sciences of Phytochemistry

    4 Jul 2026
    7 pages
  • research article

    Phytochemical Profiling with Biological Validation Reveals Therapeutic Effect of Vincetoxicum capparidifolium

    Athira Prameela, Thenmozhi Krishnasamy

    The present research discusses the phytochemical composition, anti-inflammatory, antidiabetic, and antiproliferative efficacy of Vincetoxicum capparidifolium leaf aqueous extract. Phytochemical characterization was performed using FTIR and LC-MS analysis. Network pharmacology was employed to identify potential molecular targets of tylophorine associated with liver associated disorders, followed by molecular docking studies. Anti-inflammatory activity and antidiabetic potential was evaluated in vitro. Cytotoxic outcomes were determined using MTT assay on HepG2 cells, along with AO/EtBr staining and DNA fragmentation analysis. FTIR investigation disclosed the occurrence of various functional groups, incorporating hydroxyl, amine, aromatic, and heteroatom-containing moieties. LC-MS profiling categorized a total of 28 compounds belonging to alkaloids, flavonoids, phenols, and fatty acid derivatives. Network pharmacology analysis identified 94 intersecting targets of tylophorine with liver inflammation, diabetic liver disease, and end-stage liver disease, while molecular docking showed binding affinities of tylophorine with proteins, presenting the strongest interaction with 3HHM (-8.9 kcal mol-1). The extract produced concentration-dependent inhibition of protein denaturation (9.5-68.0%), proteolytic activity (10.3-71.7%), and erythrocyte lysis (10.6-70.2%) although its activity was lower than the reference drug, aspirin. The extract also displayed inhibition of α-amylase and α-glucosidase, with greater potency against α-glucosidase (IC50=99.6 µg mL-1). The cytotoxic activity evaluated using MTT assay supported reduction in HepG2 cell viability (IC50=168 µg mL-1). AO/EtBr staining revealed increased apoptotic features, including membrane damage and nuclear condensation, while DNA fragmentation analysis verified apoptosis-mediated cell death. Overall, V. capparidifolium exhibits notable in vitro anti-inflammatory, antidiabetic, and cytotoxic potential, highlighting its potential as a source of bioactive compounds for further pharmacological investigations.

    Sciences of Phytochemistry

    11 Jul 2026
    17 pages
  • research article

    Computational Assessment of Plant-Derived Alkaloids for Anti-SARS-CoV-2 Properties

    Abhinav Maniyeri, Karthika Krishnamoorthy

    The demand for efficient antiviral treatments that go beyond traditional treatment, whose effectiveness may be compromised by viral changes and documented adverse effects following immunization, has increased due to the quick and ongoing introduction of SARS-CoV-2 variations. In this regard, a potential class of natural chemicals for SARS-CoV-2 medication development is plant-derived alkaloids, which are known for their broad-spectrum antiviral qualities. This research employs network pharmacology, gene ontology, and molecular docking to find effective alkaloid candidates that can target conserved viral proteins across SARS-CoV-2 variations. 5 bioactive alkaloids were screened against three key coronavirus proteins—2AJF (spike RBD–ACE2 complex), 2DD8 (spike RBD-neutralizing antibody complex), and 2J98 (replication-associated nsp9 protein). Binding affinities ranged from -6.0 to -11.3 kcal/mol, with Manzamine A emerging as the strongest inhibitor across all targets (2AJF: -11.3, 2DD8: -10.0, 2J98: -9.1 kcal/mol). Its stable hydrogen-bonding network and interactions with key amino acids suggest strong potential to disrupt viral entry, immune evasion mechanisms, and replication processes. Network pharmacology revealed 5, 272 SARS-CoV-2 associated genes, of which 51 overlapped with alkaloid-related targets. Venn analysis identified 6 shared genes, and protein-protein interaction (PPI) network construction highlighted critical hub regulators like MTOR, AKT1, STAT3, SYK, CASP3, and JAK2 implicated in immune modulation, apoptosis, inflammation, and viral pathogenicity. The combined computational approach identifies Manzamine A as a promising natural scaffold for anti-SARS-CoV-2 drug development. Experimental validation through in vitro, in vivo, MD simulation and pharmacokinetic research is still necessary to show clinical application, even though the results provide insightful information for future therapeutic design.

    Sciences of Phytochemistry

    12 Jul 2026
    13 pages
  • research article

    Optimization of Extraction Conditions and Kinetics of Antioxidant Compounds from Polyalthia longifolia Leaves

    Poro David Clark

    This study aimed to optimize phenolic antioxidant extraction from Polyalthia longifolia leaves using hot maceration with 70% ethanol and to characterize the extraction kinetics under optimal conditions. Response surface methodology was used to evaluate the effects of extraction time and temperature on extraction yield, total phenolic content (TPC), and ferric reducing antioxidant power (FRAP). Both factors significantly influenced all responses, with the extraction yield and TPC increasing progressively with temperature and time. FRAP, however, exhibited a dome-shaped response, peaking at intermediate temperatures before declining under prolonged high-temperature conditions, consistent with the thermal degradation of heat-labile antioxidants. The highest phenolic recovery and antioxidant activity were achieved at the upper boundary of the experimental domain, suggesting that the true optimum may lie beyond the conditions tested. Kinetic analysis further revealed that antioxidant-active compounds were mobilized faster than the bulk extractable mass, with implications for reducing extraction time and energy consumption at scale. These findings provide a statistically guided and kinetically informed foundation for the valorization of Polyalthia longifolia leaves, supporting future process optimization across broader solvent systems and extraction techniques for functional food and nutraceutical applications.

    Sciences of Phytochemistry

    9 Jul 2026
    11 pages