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Journal articles on the topic 'Phytochemical database'

Author: Grafiati

Published: 31 October 2024

Last updated: 31 July 2025

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1

Kay, Colin, Alex Smirnov, Jessica Everhart, et al. "The Metabolome of Food Knowledge Database: Development of a Nutrition Database to Support Precision Nutrition." Current Developments in Nutrition 6, Supplement_1 (2022): 1114. http://dx.doi.org/10.1093/cdn/nzac078.008.

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Abstract Objectives To develop a precision nutrition knowledge database, with the aim to provide individualized and actionable dietary recommendations to help prevent disease. However presently, dietary phytochemicals are poorly represented in current metabolomic databases. To address this gap, we are building a cloud-based knowledge database (KDB) named “The Metabolome of Food” (MetaboFood®) which focuses on phytochemical compositional, metabolite and pathway data. Methods MetaboFood® features P-MetDB®, a database in static tabular form, of nutritionally relevant phytochemicals and their meta

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Elkhattabi, Lamiae. "Data insights from a Moroccan phytochemical database (MPDB) derived from aromatic & medicinal plants." Bioinformation 19, no. 12 (2023): 1217–24. http://dx.doi.org/10.6026/973206300191217.

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The geographical location of Morocco and the diversity of its topography ensure a high variability of climate conditions, ranging from humid to Saharan, and extending through subhumid, arid, and semi-arid stages. This variability offers a high floristic diversity, while the medical use of these phytochemicals has not been fully explored. Advanced computer-aided drug discovery utilizes chemical biology to accelerate the study of phytochemicals at the molecular level and discover novel therapeutic pathways. Currently, there is no online resource for phytochemicals in Morocco. Therefore, it is of

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Ashfaq, Usman Ali, Arooj Mumtaz, Tahir ul Qamar, and Tabeer Fatima. "MAPS Database: Medicinal plant Activities, Phytochemical and Structural Database." Bioinformation 9, no. 19 (2013): 993–95. http://dx.doi.org/10.6026/97320630009993.

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Ashok, Kumar T., and B. Rajagopal. "PDTDB – An Integrative Structural Database and Prediction Server for Plant Metabolites and Therapeutic Drug Targets." International Journal of Current Research 9, no. 2 (2017): 46537–41. https://doi.org/10.5281/zenodo.562286.

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Understanding the biological phenomena of sequence, structure, function, metabolism, and molecular interactions of species is crucial to identify or analyze the biological problems in the ideal way. Integration of all data facilitates unified access to the key problem. PDTDB (Phytochemical and Drug Target DataBase) is an integrative structural database, which contains information about the plants (secondary metabolites, plant anatomy, side effects and medicinal properties), ligands (3D molecular structure, SMILES string, side effects and medicinal properties), therapeutic drug targets (3D mole

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Rathaur, Pooja, and Kaid Johar SR. "Metabolism and Pharmacokinetics of Phytochemicals in the Human Body." Current Drug Metabolism 20, no. 14 (2020): 1085–102. http://dx.doi.org/10.2174/1389200221666200103090757.

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Background: Phytochemicals are obtained from various plants and used for the treatment of diseases as both traditional and modern medicines. Poor bioavailability of phytochemicals is a major concern in applying phytochemicals as a therapeutic agent. It is, therefore, necessary to understand the metabolism and pharmacokinetics of phytochemicals for its implication as a therapeutic agent. Methods: Articles on the metabolism of phytochemicals from the PubMed database. The articles were classified into the digestion, absorption, metabolism, excretion, toxicity, and bioavailability of phytochemical

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Yasmine, Syafira, Neissya Nastiti Firmanto, Annisa Maya Sabrina, and Siti Khaerunnisa. "MOLECULAR DOCKING OF CROCUS SATIVUS PHYTOCHEMICALS AGAINST INDUCIBLE NITRIC OXIDE SYNTHASE AND PHOSPHODIESTERASE-9 IN HEART FAILURE PRESERVED EJECTION FRACTION." Majalah Biomorfologi 33, no. 1 (2023): 20–29. http://dx.doi.org/10.20473/mbiom.v33i1.2023.20-29.

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Highlights1. Heart failure preserved ejection fraction increases the mortality rate every year.2. Definitive therapy for HFpEF is not well identified.3. Crocus sativus phytochemical has anti-inflammatory and cardioprotective effects due to iNOS and PDE-9 inhibition. AbstractBackground: Heart failure preserved ejection fraction (HFpEF) is a complex disease associated with metabolic disease as a risk factor. A previous study found an association between iNOS and PDE-9 with inflammation and myocardial fibrosis in HFpEF. Objective: This study aimed to identify the potential phytochemicals of Crocu

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Rathnayake, Samith, and Samantha Weerasinghe. "Development of an Information System of Structures and Force Field Parameters of Chemical Compounds from Sri Lankan Flora." Combinatorial Chemistry & High Throughput Screening 21, no. 8 (2018): 550–56. http://dx.doi.org/10.2174/1386207321666181010113533.

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Background: Sri Lanka offers a huge diversity of flora with a large proportion of those being endemic to the island. Both the endemic and native plants species serve as a rich bank of phytochemicals. Method: In this study, “Sri Lankan Flora” an online web-based information system of phytochemical compounds isolated from the flora of Sri Lanka was proposed. Results: The database contained 3D structures of those compounds, calculated quantitativestructure- activity relationship (QSAR) data and the GROMOS 54a7 force field parameters for each and every compound. The manually curated chemical struc

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Fitriani, Ika Nur, and Wiji Utami. "Potential Phytochemical Inhibitor from Allium cepa for the Medication of COVID-19 using In-Silico Approach." ALKIMIA : Jurnal Ilmu Kimia dan Terapan 4, no. 2 (2021): 80–87. http://dx.doi.org/10.19109/alkimia.v4i2.7459.

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Infection of extreme acute respiratory syndrome coronavirus 2 triggers Coronavirus disease 2019 (COVID-19). COVID-19 has adverse consequences on persons and is getting worse in all nations. The aim of this research is to investigate the development of in-silico approach of phytochemical inhibitor used to fight COVID-19 pathway inhibition. In medicinal plants, there are many phytochemicals, however the bioactive mechanism remains uncertain. In-silico experiments offer additional evidence to confirm the inhibition of medicinal plants. Molecular docking was used to evaluate phytoconstituents from

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Zarshenas, Mohammad M., and Liselotte Krenn. "Phytochemical and Pharmacological Aspects of Salvia mirzayanii Rech. f. & Esfand." Journal of Evidence-Based Complementary & Alternative Medicine 20, no. 1 (2014): 65–72. http://dx.doi.org/10.1177/2156587214553938.

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Salvia mirzayanii Rech. f. & Esfand is an endemic herbaceous plant belonging to the Lamiaceae family. The plant grows in the center and south of Iran and is broadly used in folk medicine. This review focuses on phytochemical and pharmacological data of S mirzayanii. Databases such as PubMed, Scopus, Web of Science, Scientific Information Database (Iranian database involving English and Persian articles), and Google Scholar were searched for terms “ Salvia mirzayanii,” “Iranian sage,” “ Marv-e-Talkh,” and “ Moor-e-Talkh” in both Persian and English up to December 10, 2013. In line with the

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Fatima, Shehnaz, Payal Gupta, Shilpa Sharma, Ashish Sharma, and Subhash M. Agarwal. "ADMET profiling of geographically diverse phytochemical using chemoinformatic tools." Future Medicinal Chemistry 12, no. 1 (2020): 69–87. http://dx.doi.org/10.4155/fmc-2019-0206.

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Aim: Phytocompounds are important due to their uniqueness, however, only few reach the development phase due to their poor pharmacokinetics. Therefore, preassessing the absorption, distribution, metabolism, excretion and toxicity (ADMET) properties is essential in drug discovery. Methodology: Biologically diverse databases (Phytochemica, SerpentinaDB, SANCDB and NuBBEDB) covering the region of India, Brazil and South Africa were considered to predict the ADMET using chemoinformatic tools (Qikprop, pkCSM and DataWarrior). Results: Screening through each of pharmacokinetic criteria resulted in i

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LİNGFA, Lali, Aravinda TİRUMALA, and Srinivas ANKANAGARİ. "GC-MS profiling of anticancer and antimicrobial phytochemicals in the vegetative leaf, root, and stem of Withania somnifera (L.) Dunal." International Journal of Secondary Metabolite 11, no. 1 (2023): 63–77. http://dx.doi.org/10.21448/ijsm.1256932.

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Withania somnifera has been used for a long time in traditional medicine. Its crude extract, dried powder, and purified metabolites from mature plants have shown promising therapeutic potential. To further investigate its potential, the detection of phytochemicals with anticancer and antimicrobial properties in the vegetative stage is essential. Hence, this study was done to identify phytochemical constituents using GC-MS analysis for anticancer and antimicrobial activities in the vegetative stage from methanolic extracts of stem, leaf, and root in W. somnifera. The air-dried plant parts were

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Lingfa, Lali, and Srinivas Ankanagari. "GC-MS Profiling of Reproductive Stage Withania somnifera for Antimicrobial and Anticancer Phytochemicals." Biomedical and Pharmacology Journal 16, no. 1 (2023): 197–211. http://dx.doi.org/10.13005/bpj/2601.

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Withanias omnifera also known as Indian ginseng is commonly found in India and other Southeast Asian countries. Various parts of this plant have been used as herbal medicine to treat a variety of diseases. However, there is a lacuna in the profiling of phytochemical constituents present in the different parts of the plant at reproductive stage. To identify phytochemicals present in the methanolic extracts of leaf, root, and stem parts of W. somnifera at reproductive stage using GC-MS analysis. Methods: The airdried parts of plant (leaf, stem and root) were extracted with methanol and concentra

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Yudhani, Ratih Dewi, Khariz Fahrurrozi, and Dono Indarto. "New Cholesteryl Ester Transfer Protein from Indonesian Herbal Plants as Candidate Treatment of Cardiovascular Disease." Open Access Macedonian Journal of Medical Sciences 10, A (2022): 1624–29. http://dx.doi.org/10.3889/oamjms.2022.10457.

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BACKGROUND: There is a strong negative relationship between high-density lipoprotein cholesterol (HDL-C) and the risk of cardiovascular disease (CVD). Cholesterol ester transfer protein (CETP) is a glycoprotein transporter that transfers cholesterol esters to very low-density lipoprotein and low-density lipoprotein cholesterol (LDL-C). The CETP inhibitor is a new strategy against CVD because of its ability to increase HDL-C. Various Indonesian plants have not been optimally used, and in silico phytochemical screening of these plants showing potential as CETP inhibitors is still limited. AIM: T

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Sahu, Pramod Kumar, Pranab Kishor Mohapatra, Dhanji Popatbhai Rajani, and Mukesh Kumar Raval. "Structure-based Discovery of Narirutin as a Shikimate kinase Inhibitor with Anti-tubercular Potency." Current Computer-Aided Drug Design 16, no. 5 (2020): 523–29. http://dx.doi.org/10.2174/1573409915666191025112150.

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Background:: Shikimate pathway is essential for tubercular bacillus but it is absent in mammals. Therefore, Shikimate kinase and other enzymes in the pathway are potential targets for the development of novel anti-tuberculosis drugs. Objective:: In the present study, Shikimate kinase is selected as the target for in silico screening of phytochemicals with an aim to discover a novel herbal drug against Mycobacterium tuberculosis (Mtb). Methods:: A structure-based drug discovery approach is undertaken for the execution of the objective. Virtual screening of phytochemical database NPACT against t

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Osafo, Newman, Kwesi Boadu Mensah, and Oduro Kofi Yeboah. "Phytochemical and Pharmacological Review of Cryptolepis sanguinolenta (Lindl.) Schlechter." Advances in Pharmacological Sciences 2017 (2017): 1–13. http://dx.doi.org/10.1155/2017/3026370.

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Ethnopharmacological Relevance. Cryptolepis sanguinolenta is a scrambling thin-stemmed shrub found in Africa. Traditionally in West Africa, it is employed in the treatment of malaria, diarrhea, and respiratory conditions. This review discusses the traditional importance as well as the phytochemical, ethnomedical, pharmacological, and toxicological importance of this plant. Materials and Methods. Excerpta Medica Database, Google Scholar, Springer, and PubMed Central were the electronic databases used to search for and filter primary studies on Cryptolepis sanguinolenta. Results. The detailed re

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Koirala, Alisa, Agnidhar Devkota, and Meena Rajbhandari. "Phytochemical evaluation of Aglaomorpha coronans from Nepal." Scientific World 17, no. 17 (2024): 91–98. http://dx.doi.org/10.3126/sw.v17i17.66440.

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The rhizomes of Aglaomorpha coronans is used to cure back pain by the local people of Lamjung district. The medicinal value depends on the presence of biologically active phytochemicals with drug like properties. Phytochemical evaluation of A. coronans of Nepalese origin has not been reported yet. Hence, the present study is focused on the phytochemical analysis, evaluation of antioxidant, antibacterial activities of various extracts and GC-MS profiling of ethyl acetate extract. The rhizomes were extracted with the hexane, chloroform, ethylacetate, methanol and 50% aqueous methanol. Phytochemi

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Harrison, Andrew M., Fabrice Heritier, Bennett G. Childs, J. Michael Bostwick, and Mikhail A. Dziadzko. "Systematic Review of the Use of Phytochemicals for Management of Pain in Cancer Therapy." BioMed Research International 2015 (2015): 1–8. http://dx.doi.org/10.1155/2015/506327.

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Pain in cancer therapy is a common condition and there is a need for new options in therapeutic management. While phytochemicals have been proposed as one pain management solution, knowledge of their utility is limited. The objective of this study was to perform a systematic review of the biomedical literature for the use of phytochemicals for management of cancer therapy pain in human subjects. Of an initial database search of 1,603 abstracts, 32 full-text articles were eligible for further assessment. Only 7 of these articles met all inclusion criteria for this systematic review. The average

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Kumar, Khushal, Sumedh Joshi, Shalini Rai, and Anand B. More. "Bimodal Approach of Phytochemical Profiling of Panchakol Churna: A Polyherbal Formulation." Indian Journal of Ayurveda and Integrative Medicine KLEU 5, no. 2 (2024): 71–77. https://doi.org/10.4103/ijaim.ijaim_29_24.

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ABSTRACT Introduction: Phytochemicals from medicinal plants are crucial in traditional systems like Ayurveda and are increasingly important in modern healthcare. Panchakol Churna, a polyherbal Ayurvedic formulation, is known for various therapeutic properties. This study aims to profile the bioactive compounds in Panchakol Churna using a bimodal approach that combines the Indian Medicinal Plants, Phytochemistry and Therapeutics (IMPPAT) database with high-resolution liquid chromatography–mass spectrometry (HRLCMS). Materials and Methods: Panchakol Churna was prepared according to the Ayurvedic

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Salehi, Bahare, Pia Lopez-Jornet, Eduardo Pons-Fuster López, et al. "Plant-Derived Bioactives in Oral Mucosal Lesions: A Key Emphasis to Curcumin, Lycopene, Chamomile, Aloe vera, Green Tea and Coffee Properties." Biomolecules 9, no. 3 (2019): 106. http://dx.doi.org/10.3390/biom9030106.

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Oral mucosal lesions have many etiologies, including viral or bacterial infections, local trauma or irritation, systemic disorders, and even excessive alcohol and tobacco consumption. Folk knowledge on medicinal plants and phytochemicals in the treatment of oral mucosal lesions has gained special attention among the scientific community. Thus, this review aims to provide a brief overview on the traditional knowledge of plants in the treatment of oral mucosal lesions. This review was carried out consulting reports between 2008 and 2018 of PubMed (Medline), Web of Science, Embase, Scopus, Cochra

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Bhavana R. Tambe, Sunayana R. Vikhe, and Parmeshwar M. Pathade. "Detection of phytochemicals in the methanol extract of Urginea indica (R.) BULB." World Journal of Biology Pharmacy and Health Sciences 21, no. 1 (2025): 768–73. https://doi.org/10.30574/wjbphs.2025.21.1.0025.

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Urginea indica R, commonly known as Jangli Pyaz, belongs to the Liliaceae family and is renowned for its medicinal properties, particularly in traditional Indian medicine. This research focuses on the extraction and detection of phytochemicals from the bulbs of Urginea indica R, highlighting their potential therapeutic applications. Utilizing Soxhlet extraction with methanol as a solvent, we successfully extracted a range of bioactive compounds, including flavonoids, tannins, and alkaloids. The extraction process involved grinding the dried bulbs into a coarse powder and conducting prolonged m

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Wang, Jingwei, Ling Peng, Lu Jin, Huiying Fu, and Qiyang Shou. "Network Pharmacology Analysis of the Identification of Phytochemicals and Therapeutic Mechanisms of Paeoniae Radix Alba for the Treatment of Asthma." Journal of Immunology Research 2021 (September 14, 2021): 1–11. http://dx.doi.org/10.1155/2021/9659304.

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Background. Paeoniae Radix Alba (PRA), the root of the plant Paeonia lactiflora Pall., has been suggested to play an important role for the treatment of asthma. A biochemical understanding of the clinical effects of Paeoniae Radix Alba is needed. Here, we explore the phytochemicals and therapeutic mechanisms via a systematic and comprehensive network pharmacology analysis. Methods. Through TCMSP, PubChem, GeneCards database, and SwissTargetPrediction online tools, potential targets of active ingredients from PRA for the treatment of asthma were obtained. Cytoscape 3.7.2 was used to determine t

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Sankaranarayanan, Pranaya, Dicky John Davis G, Abhinand PA, M. Manikandan, and Arabinda Ghosh. "Molecular docking and MD simulation approach to identify potential phytochemical lead molecule against triple negative breast cancer." F1000Research 13 (March 18, 2025): 1271. https://doi.org/10.12688/f1000research.155657.2.

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Background Triple-negative breast cancers (TNBC) are defined as tumors that lack the expression of the estrogen receptor (ER), progesterone receptor (PR), and human epidermal growth factor receptor 2 (HER2). It exhibits unique clinical and pathological features, demonstrates high aggressiveness, and has a relatively poor prognosis and clinical outcome. Objective To identify a novel drug target protein against TNBC and potential phytochemical lead molecules against the identified target. Methods In this study, we retrieved TNBC samples from NGS and microarray datasets in the Gene Expression Omn

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Suchitra, Sanasam1 Thoudam Bhaigyabati2 Loitongbam Ranjit Singh3*. "GC-MS Profiling of Aqueous and Methanolic Extracts of Meyna Laxiflora Robyns Leaf." International Journal of Pharmaceutical Sciences 3 (January 22, 2025): 1903–15. https://doi.org/10.5281/zenodo.14719584.

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Plants are the good source of various phytochemicals and secondary metabolites which are used in medicine and environmental sectors as well as being widely used in commercial and pharmaceutical products. In our earlier study we have reported the preliminary phytochemical screening and antioxidant activity of aqueous and methanolic extracts of Meyna laxiflora Robyn leaf. The current study was carried out to analyze the active phytoconstituents present in the aqueous and methanolic extracts of leaf of Meyna laxiflora Robyns using GC-MS and the spectrum of unknown compounds was compared with the

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Ezealisiji, Kenneth Maduabuchi, and Precious Tobechukwu Okoh. "Advanced phytochemistry and chemo-metric profiling of the bioactive medicinal components of n-hexane seed extract of Xylopia aethiopica using FTIR and GC-MS techniques." GSC Biological and Pharmaceutical Sciences 22, no. 1 (2023): 247–56. https://doi.org/10.5281/zenodo.7661349.

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The use of herbal medicine has achieved global success as an ethno-medicine, yet there are lots of drawbacks in their commercial value and wide acceptance due to poor regulation and standardization. Present study aims to chemo-metrically characterize the phyto-chemical principles present in the n-hexane seed extracts of <em>Xylopia aethiopica</em> using chromatographic and spectroscopic methods. The crude n-hexane extracts were analyzed using Fourier Transform Infrared Spectroscopy (FTIR) model 8400S and GC-MS (Model-QP 2010 plus Spec). The identification of compounds was done using

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Umamahesh, Katike, Arumugam D. Gandhi, and Obulam V. S. Reddy. "Ethnopharmacological Applications of Mango (Mangiferaindica L.) Peel - A Review." Current Pharmaceutical Biotechnology 21, no. 13 (2020): 1298–303. http://dx.doi.org/10.2174/1389201021666200420075759.

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Background: Mango peel is a major by-product of mango (Mangifera Indica L.) fruit that belongs to the Anacardiaceae family. It is a tropical or subtropical fruit and is a potent source of polyphenolic contents. In traditional medicines, mango peel extract has been commonly used, either singly or in combination with other plant extracts against different ailments since ancient times. Methods: An electronic database search for accepted articles in Pubmed, Google Scholar, Researchgate, Google, Scopus and Science Direct was used to review the scientific inputs by searching appropriate keywords. So

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Huma, Qureshi, Anwar Tauseef, Khan Sadiqullah, Fatimah Hina, and Waseem Muhammad. "Phytochemical constituents of Broussonetia papyrifera (L.) L'He'r. ex Vent: An overview†." Journal of Indian Chemical Society Vol. 97, Jan 2020 (2020): 55–65. https://doi.org/10.5281/zenodo.5651019.

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Department of Biological Sciences (Botany Program), Gomal University, Dera Ismail Khan-29050, Pakistan Department of Botany, Pir Mehr Ali Shah Arid Agriculture University, Rawalpindi-46300, Pakistan <em>E-mail</em>: humaqureshi8@gmail.com Department of Environmental Science, Gomal University, Dera Ismail Khan-29050, Pakistan Department of Biology, Allama Iqbal Open University, Islamabad-46000, Pakistan <em>Manuscript received online 15 October 2019, revised and accepted 06 January 2020</em> Phytochemistry is an important field of plant biology with a number of applied research applications. Wh

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Ravi, Deva Asirvatham, Du Hyeon Hwang, Ramachandran Loganathan Mohan Prakash, Changkeun Kang, and Euikyung Kim. "Indian Medicinal Plant-Derived Phytochemicals as Potential Antidotes for Snakebite: A Pharmacoinformatic Study of Atrolysin Inhibitors." International Journal of Molecular Sciences 25, no. 23 (2024): 12675. http://dx.doi.org/10.3390/ijms252312675.

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Snakebite envenoming is a significant health threat, particularly in tropical regions, causing substantial morbidity and mortality. Traditional treatments, including antivenom therapy, have limitations and associated risks. This research aims to discover novel phytochemical antidotes for snakebites, specifically targeting the western diamondback rattlesnake (Crotalus atrox) venom metalloproteinase Atrolysin. Utilizing pharmacoinformatic techniques such as molecular docking, high-throughput ligand screening, pharmacophore mapping, pharmacokinetic profiling, and molecular dynamics (MD) simulatio

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Pathania, Shivalika, Sai Mukund Ramakrishnan, and Ganesh Bagler. "Phytochemica: a platform to explore phytochemicals of medicinal plants." Database 2015 (2015): bav075. http://dx.doi.org/10.1093/database/bav075.

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Christopher Busayo Olowosoke, Adebola Abosede Alaba, and Benjamin Babatunde Adegboyega. "Citrullus lanatus natural product library: A hoard of viable potential inhibitor candidates for diabetes mellitus type II therapeutic target enzymes." World Journal of Advanced Research and Reviews 15, no. 1 (2022): 534–60. http://dx.doi.org/10.30574/wjarr.2022.15.1.0713.

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The ethnomedicinal function of several cucurbit species (cucumber, squash, melon, gourd, etc.) on diseases (i.e. diabetes, microbial infections, cancer, etc.), and as free radical scavengers have been reported. However, there remains infinitesimal record on citron watermelon broad use, which reflects the reason for wide oversight of underutilization, from lack of recognition for functional food crop development and commercialization. The objective of this study focus towards identifying the natural phytochemicals of C. lanatus on water melon molecules online database for insilico computational

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Christopher, Busayo Olowosoke, Abosede Alaba Adebola, and Babatunde Adegboyega Benjamin. "Citrullus lanatus natural product library: A hoard of viable potential inhibitor candidates for diabetes mellitus type II therapeutic target enzymes." World Journal of Advanced Research and Reviews 15, no. 1 (2022): 534–60. https://doi.org/10.5281/zenodo.7745429.

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The ethnomedicinal function of several cucurbit species (cucumber, squash, melon, gourd, etc.) on diseases (i.e. diabetes, microbial infections, cancer, etc.), and as free radical scavengers have been reported. However, there remains infinitesimal record on citron watermelon broad use, which reflects the reason for wide oversight of underutilization, from lack of recognition for functional food crop development and commercialization. The objective of this study focus towards identifying the natural phytochemicals of <em>C. lanatus</em> on water melon molecules online database for ins

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Sankaranarayanan, Pranaya, Dicky John Davis G, Abhinand PA, M. Manikandan, and Arabinda Ghosh. "Molecular docking and MD simulation approach to identify potential phytochemical lead molecule against triple negative breast cancer." F1000Research 13 (October 24, 2024): 1271. http://dx.doi.org/10.12688/f1000research.155657.1.

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Background Triple-negative breast cancers are defined as tumors that lack the expression of the estrogen receptor (ER), progesterone receptor (PR), and human epidermal growth factor receptor 2 (HER2). It exhibits unique clinical and pathological features, is highly aggressive, and has a relatively poor prognosis and poor clinical outcome. Objective To identify a novel drug target protein against triple-negative breast cancer (TNBC) and potential phytochemical lead molecules against novel drug targets. Methods In this study, we retrieved TNBC samples from NGS and microarray datasets in the Gene

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Perumal, Vikneswari, Tavamani Balan, Nurul Fateha Muhamad Nizam, et al. "Thottea grandiflora: A Review on its Traditional Uses, Phytochemical Constituents and Pharmacological Actions." ASM Science Journal 19 (December 10, 2024): 1–12. https://doi.org/10.32802/asmscj.2023.1672.

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Thottea grandiflora is a plant commonly called “Hempedu Beruang” and is widely distributed in Peninsular Malaysia. T. grandiflora plant’s part is used in folk medicine for health benefits such as fever, asthma, cough, diabetes, malaria, stomach disorder, back pain, and lung tumours. This plant has reported pharmacological activities like antidiabetic, anti-inflammatory, antimicrobial, antifungal, and antihyperglycemic. However, this plant is not much explored despite many traditional claims by the local tribes on the potential use of the plant. This study aimed to review the botanical characte

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Brescia, Valerio. "Computational Analysis and Phytochemical Screening Targeting Dihydrolipoamide Dehydrogenase (DLD) for Alzheimer's Disease: A Molecular Dynamics Simulation Study." European journal of volunteering and community-based projects 1, no. 2 (2024): 70–94. https://doi.org/10.5281/zenodo.12683808.

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<strong>Abstract: </strong>The decreasing rate of metabolisms within the mitochondrial is connected to the progressive characterization of Alzheimer's Disease (AD). Dihydrolipoamide dehydrogenase (dld), and DLD1 are specific chemicals comprised of two enzymes/complexes of protein; pyruvate dehydrogenase and α-ketoglutarate dehydrogenase physiologically related to AD and have a noteworthy function in energy metabolism. The present computational study was designed to envisage a rational screening of natural phytochemical compounds against DLD1 in AD. The molecular docking and virtual scree

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Mahayana, Ngakan Putu Krishna, Ni Nyoman Ayu Dewi, I. Made Winarsa Ruma, and Desak Made Wihandani. "IN SILICO SCREENING OF PHYTOCHEMICAL COMPOUND AS NOVEL NOX1 INHIBITOR VIA INHIBITING P47PHOX-P22PHOX COMPLEX." E-Jurnal Medika Udayana 14, no. 2 (2025): 23. https://doi.org/10.24843/mu.2025.v14.i2.p05.

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The world’s elderly population is increasing. Thus, in the future, degenerative diseases incidence will increase. Therefore, the development of anti-aging agent is required. NADPH oxidase (NOX), especially NOX1, has important roles in aging and degenerative diseases. NOX1 activation required interaction between p47phox and p22phox subunit. Based on that mechanism, compound that has ability to inhibit p47phox-p22phox complex development could become an anti-aging agent. The aim of this study is to find novel NOX1 inhibitors candidate from phytochemical database that work via inhibiting p47phox-

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Purba, Febi Anjaini, Diky Setya Diningrat, Ayu Nirmala Sari, Novita Sari Harahap, and Kusdianti -. "Antiviral Compounds Analysis in Ethanol and Methanol Extracts of Jamblang Fruit (Syzygium cumini) Using the GCMS Method." Kalwedo Sains (KASA) 2, no. 2 (2021): 83–94. http://dx.doi.org/10.30598/kasav2i2p83-94.

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Jamblang fruit (Syzygium cumini) is a plat that has been scientifically researched to have medicinal properties.This study aims to determine the content of bioactive compounds contained in the petiole by Gas Chromathography Mass Spectrophotometer (GCMS) method. The study used gas chromatographic tools and mass spectra which were evaluated using MASSLAB program. The data obtained from the GCMS machine is then analyzed using the NCBI database pubchem software (https://pubchem.ncbi.nlm.nih.gov/). The result showed that there were 61 phytochemical compounds in jamblang root ethanol extracts and 33

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-, Winarsih, Diky Setya Diningrat, Ayu Nirmala Sari, Novita Sari Harahap, and Kusdianti -. "Antiviral Potential Analysis of Jamblang Seed Essential Oil (Syzygium cumini) Using GCMS." Kalwedo Sains (KASA) 2, no. 2 (2021): 95–105. http://dx.doi.org/10.30598/kasav2i2p95-105.

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Jamblang (Syzygium cumini) essential oil is another form of extraction to explore its potential medicinal properties. This study aims to determine the content of bioactive compounds contained in seed essential oil using the Gas Chromatography Mass Spectophotometer (GCMS) approach. Jamblang seed essential oil is produced through a steam distillation process. The results of the GCMS analysis were evaluated using the MASSLAB program. The data obtained from the GCMS tool was then further analyzed using the PubChem NCBI database software (https://pubchem.ncbi.nlm.nih.gov/) and PASS online. The resu

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Adase, Emmanuel, Peter Ankutse, Doris Kumadoh, et al. "“A Review of Parquetina nigrescens (Afzel.) Bullock, A Plant for Traditional Medicine: Phytochemical and Pharmacological Properties”." Evidence-Based Complementary and Alternative Medicine 2022 (November 16, 2022): 1–21. http://dx.doi.org/10.1155/2022/6076707.

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The development of herbal medicines as a remedy for several illnesses has been recognized and accepted worldwide by health experts. Parquetina nigrescens is a perennial evergreen woody climber from the Apocynaceae family, widely used in Africa for the treatment of many diseases. The current study is intended to review and put together information available on this ethno-medicinal plant, which will improve scientific knowledge about the plant and also identify research areas that need to be investigated further. The information related to the plant was obtained using scientific databases such a

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N, Mishra D., Gomare K. S, and Sheelwant S. V. "GC-MS Analysis and Phytochemical Screening of Indigofera tinctoria (Linn.) Leaf Extract Characterizing its Medicinal Use." International Journal of Ayurvedic Medicine 11, no. 2 (2020): 289–99. http://dx.doi.org/10.47552/ijam.v11i2.1540.

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Indigofera tinctoria (Linn.), a perennial shrub belongs to the family Fabaceae (Leguminosae) is well known in Indian system of medicines for its traditional uses. The present study was carried to find out the possible bioactive components in the leaves of this plant in ethanol extract by Gas Chromatography-Mass Spectrometry (GC-MS) analysis and the therapeutic uses of each compound as per PASS and other database. The mass spectra of the extract found compounds that were matched with the National Institute of Standards and Technology (NIST version 5.7.1) library database. The GC-MS study observ

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Kumari, Amulya, Amit Patnaik, Vinay Oraon, and Latika Sharan. "GC-MS profiling of phytochemicals present in ethanolic extract of Bauhinia variegata L. Leaves." South Asian Journal of Experimental Biology 13, no. 3 (2023): 173–80. http://dx.doi.org/10.38150/sajeb.13(3).p173-180.

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Bauhinia variegata L. is an ethnomedicinal plant belonging to the family Fabaceae and subfamily Caesalpiniaceae; commonly known as Kachnar, Mountain ebony, Koinar saag and Orchid tree. It is native to China, Indian-subcontinent and South eastern Asia. Ethnomedicinally it is used for the treatment of diarrhoea, mouth ulcer, hepatomegaly, tonsilitis, cyst and fibroid in uterus, burning sensation in urine and diabetes. It has pharmacological properties like antimicrobial, antioxidant, antidiabetic, anticancer, anti-inflammatory and hepatoprotective. For present study ethanolic extract was prepare

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Sheokand, Deepak, Annu Grewal, Vivek Kumar, Raveena Chauhan, Vandana Saini та Ajit Kumar. "In Silico Evaluation of Marine Phytochemicals as Potential Inhibitors of Inhibitor-Kappa B Protein Kinase (IκK) for Alzheimer’s Disease Therapeutics". Biosciences Biotechnology Research Asia 21, № 3 (2024): 1063–76. http://dx.doi.org/10.13005/bbra/3286.

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ABSTRACT: Alzheimer's disease (AD) is a polygenic, progressive neurodegenerative condition that leads to cognitive and behavioural impairment. The drugs available for AD have been found vital for symptomatic cognitive treatment, but cannot treat or slow down the disease's progression, besides having severe side effects. Plants have been extensively used in traditional medicine, and marine phytochemicals have also been proven as a legitimate solution for several ailments. This study was carried out to screen marine phytochemicals for AD therapy and neuroinflammation by focusing on inhibiting th

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Alnuqaydan, Abdullah M., and Bilal Rah. "Tamarix articulata (T. articulata) - An Important Halophytic Medicinal Plant with Potential Pharmacological Properties." Current Pharmaceutical Biotechnology 20, no. 4 (2019): 285–92. http://dx.doi.org/10.2174/1389201020666190318120103.

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Background:Tamarix Articulata (T. articulata), commonly known as Tamarisk or Athal in Arabic region, belongs to the Tamaricaece species. It is an important halophytic medicinal plant and a good source of polyphenolic phytochemical(s). In traditional medicines, T. articulata extract is commonly used, either singly or in combination with other plant extracts against different ailments since ancient times.Methods:Electronic database survey via Pubmed, Google Scholar, Researchgate, Scopus and Science Direct were used to review the scientific inputs until October 2018, by searching appropriate keyw

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Muhammad Taher, Muhammad Taher, Najah Fatehah Mohd Razali, Deny Susanti Deny Susanti, Md Atiar Rahman, Muh Ade Artasasta, and Zainul Amiruddin Zakaria. "Phytochemical Constituents and Pharmacological Activities of Picrasma javanica: Quassinoids Interest." Sains Malaysiana 51, no. 3 (2022): 757–74. http://dx.doi.org/10.17576/jsm-2022-5103-10.

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Picrasma javanica Blume is a plant belonging to Simaroubaceae. It is known for its secondary metabolites, namely quassinoids, offering various pharmacological properties including antitumor, antimalarial, and antiviral. The plant is traditionally used as a source medicine for different diseases in Myanmar, Thailand, and Indonesia. Despite the extensive studies on P. javanica, there is no concise and conclusive information regarding the phytochemical and phytochemistry of the plant has been reported. Thus, we aimed to discern the phytochemical constituents and pharmacological activities of P. j

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Hakim, Iman A., Vern Hartz, Ellen Graver, Robin Whitacre, and David Alberts. "Development of a questionnaire and a database for assessing dietary D-limonene intake." Public Health Nutrition 5, no. 6a (2002): 939–45. http://dx.doi.org/10.1079/phn2002371.

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AbstractObjective:Increasing recognition of the potential importance of phytochemicals in the aetiology of cancer and heart diseases has highlighted the need for methods to measure individual phytochemical consumption that are sufficiently simple to be used in large epidemiological studies and whose reproducibility and accuracy have been quantified. D-Limonene is a natural component of a variety of foods and beverages and is found mainly in citrus fruits. However, D-limonene is not assessed by any nationally available analysis database.Design:We designed our study to assess the D-limonene cont

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Clifford, Tom, Jarred P. Acton, Stuart P. Cocksedge, Kelly A. Bowden Davies, and Stephen J. Bailey. "The effect of dietary phytochemicals on nuclear factor erythroid 2-related factor 2 (Nrf2) activation: a systematic review of human intervention trials." Molecular Biology Reports 48, no. 2 (2021): 1745–61. http://dx.doi.org/10.1007/s11033-020-06041-x.

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AbstractWe conducted a systematic review of human trials examining the effects of dietary phytochemicals on Nrf2 activation. In accordance with the PRISMA guidelines, Medline, Embase and CAB abstracts were searched for articles from inception until March 2020. Studies in adult humans that measured Nrf2 activation (gene or protein expression changes) following ingestion of a phytochemical, either alone or in combination were included. The study was pre-registered on the Prospero database (Registration Number: CRD42020176121). Twenty-nine full-texts were retrieved and reviewed for analysis; of t

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Guillén-Sánchez, Jhoseline Stayce, Walter Rojas-Villacorta, and Ricardo Diego Duarte Galhardo de Albuquerque. "Andean Fabaceae Species with Pharmacological Potential: Exploration of Antioxidant, Anticarcinogenic, and Antimicrobial Properties." Agriculture 14, no. 12 (2024): 2337. https://doi.org/10.3390/agriculture14122337.

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The objective of the present study was to explore the pharmacological potential of three Andean Fabaceae species—Prosopis pallida (algarrobo), Caesalpinia spinosa (tara), and Inga feuilleei (pacae)—as well as their phytochemical composition and traditional uses. A search was conducted in the Scopus database, and the bibliometric analysis was performed using VOSviewer version 1.6.20. The interventions included antioxidant, anticancer, and antimicrobial properties. Tara exhibited the highest antioxidant capacity and phenolic compounds, followed by pacae and algarrobo, with flavonoids such as que

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Jiragale, Pooja G., Mahadev B. Gundakalle, Rachana K. Patil, Peraira Jackulin J, Ajit Lingayat, and Divya Khare. "NETWORK PHARMACOLOGY BASED ASSESSMENT ON GUDUCHI (TINOSPORA CORDIFOLIA) IN THE MANAGEMENT OF PSORIASIS." INDIAN DRUGS 61, no. 12 (2024): 63–69. https://doi.org/10.53879/id.61.12.14800.

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Psoriasis is a chronic inflammatory disease that significantly affects individuals and places a considerable burden on healthcare systems globally. This study employs network pharmacology to elucidate the herb Guduchi’s protein interactions in modulating psoriasis pathogenesis. Bioactive compounds of Tinospora cordifolia were gathered from multiple research journals. PubChem CID-associated phytochemical was evaluated for drug likeness according to Lipinski’s “rule of 5” using the Swiss ADME database and the target genes were predicted from BindingDB. Pathway analysis was done through KEGG and

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Sun, Yue, George Binh Lenon, and Angela Wei Hong Yang. "Phellodendri Cortex: A Phytochemical, Pharmacological, and Pharmacokinetic Review." Evidence-Based Complementary and Alternative Medicine 2019 (April 1, 2019): 1–45. http://dx.doi.org/10.1155/2019/7621929.

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Background. Phellodendri Cortex (PC) or Huang Bai. According to the scientific database of China Plant Species and Chinese pharmacopeia 2015 edition, PC has two main species which are Phellodendron amurense Rupr (PAR) or “Guan Huang bai” in Chinese and Phellodendron chinense Schneid (PCS) or “Chuan Huang bai” in Chinese. The crude drugs of PAR and PCS are also called Phellodendri amurensis cortex (PAC) and Phellodendri chinense cortex (PCC), respectively. The medicinal part of the plant is the dried trunk bark. PC has comprehensive therapeutic effects which include anti-inflammatory, antimicro

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Calabria, Lalita M., Vicente P. Emerenciano, Marcelo J. P. Ferreira, Marcus T. Scotti, and Tom J. Mabry. "A Phylogenetic Analysis of Tribes of the Asteraceae Based on Phytochemical Data." Natural Product Communications 2, no. 3 (2007): 1934578X0700200. http://dx.doi.org/10.1177/1934578x0700200310.

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This work describes the first phylogenetic analysis of the entire Asteraceae based only on chemical data. The data matrix used in this study was based on a large chemical database comprising ~400 skeletal types of terpenes, coumarins, flavonoids, benzofurans and polyacetylenes isolated from the family. Hypotheses about the relationships among tribes are discussed based on the chemical data and compared with relationships inferred from the morphological and macromolecular based classifications.

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Shukri, Nur Afifah Mohd, and Mizaton Hazizul Hasan. "Pharmacological Review of Vitex trifolia." International Journal of Pharmaceuticals, Nutraceuticals and Cosmetic Science 3 (June 29, 2021): 49–65. http://dx.doi.org/10.24191/ijpnacs.v3.05.

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Vitex triflolia is one of the Vitex species where known as Lemuni. It is widely used traditionally to reduce pain, fever and minor ailments. Every part of the plant had its advantages; for example, the leaves part can relieve pain, treat fever and can help to improve memory. It has potent pharmacological activities such as antioxidant, antinociceptive, anti-inflammatory and anticancer. Other than that, every part of the plant has unique constituents with different biological activities. A few isolated and identified flavonoids in V. trifolia include casticin, persinogenin, artemetin, luteolin,

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Ayadi, Jawaher, Mohamed Debouba, Rami Rahmani, and Jalloul Bouajila. "Brassica Genus Seeds: A Review on Phytochemical Screening and Pharmacological Properties." Molecules 27, no. 18 (2022): 6008. http://dx.doi.org/10.3390/molecules27186008.

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Traditionally, Brassica species are widely used in traditional medicine, human food, and animal feed. Recently, special attention has been dedicated to Brassica seeds as source of health-promoting phytochemicals. This review provides a summary of recent research on the Brassica seed phytochemistry, bioactivity, dietary importance, and toxicity by screening the major online scientific database sources and papers published in recent decades by Elsevier, Springer, and John Wiley. The search was conducted covering the period from January 1964 to July 2022. Phytochemically, polyphenols, glucosinola

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