Computational study of ADME-Tox prediction of selected phytochemicals from <i>Punica granatum</i> peels-Reference-Cited by-同舟云学术

Computational study of ADME-Tox prediction of selected phytochemicals from Punica granatum peels

Published:2024-01-01 Issue:1 Volume:22 Page:
ISSN:2391-5420
Container-title:Open Chemistry
language:en
Short-container-title:

Author:

Batool Aneeqa¹,Parveen Shagufta¹,Shafiq Nusrat¹,Rashid Maryam¹,Salamatullah Ahmad Mohammad²,Ibenmoussa Samir³,Bourhia Mohammed⁴⁵

Affiliation:

1. Synthetic and Natural Product Drug Discovery Laboratory, Department of Chemistry, Government College Women University Faisalabad , Faisalabad , 38000 , Pakistan

2. Department of Food Science & Nutrition, College of Food and Agricultural Sciences, King Saud University , 11 P.O. Box 2460 , Riyadh , 11451 , Saudi Arabia

3. Laboratory of Therapeutic and Organic Chemistry, Faculty of Pharmacy, University of Montpellier , Montpellier , 34000 France

4. Department of Chemistry and Biochemistry, Faculty of Medicine and Pharmacy, Ibn Zohr University , Laayoune , 70000 , Morocco

5. Laboratory of Chemistry-Biochemistry, Environment, Nutrition, and Health, Faculty of Medicine and Pharmacy, University Hassan II , B. P. 5696, Casablanca , Morocco

Abstract

Abstract Pomegranate (Punica granatum) is one of the oldest well-known edible fruits, which has originated in Central Asia but now it has a widespread geographical distribution throughout the world. Phytochemicals are isolated from the pomegranate peels that show different nutritional and pharmaceutical properties. Absorption, distribution, metabolism, excretion, and toxicity (ADME-Tox) were performed to check the adsorption, distribution, metabolism, excretion, and toxicity of compounds. Previous studies mainly focused on the physico-chemical properties but other parameters are also important for the ADMET study. Six active phytochemicals B9, B29, B30, B45, B55, and B70 show good ADMET properties and can be used for drug discovery in the future.

Publisher

Walter de Gruyter GmbH

Link

https://www.degruyter.com/document/doi/10.1515/chem-2023-0188/pdf

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