The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation
<i>Abutilon indicum L.</i> (Malvaceae), more often referred to as Peeli booti, Kanghi, and Kakhi, is a perennial shrub found in many countries of Asia. Traditionally, this plant is used as a diuretic to treat inflammation, discomfort, urethral infections, and gout. Inflammation and pain...
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MDPI AG
2022-09-01
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| Series: | Plants |
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| Online Access: | https://www.mdpi.com/2223-7747/11/19/2583 |
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| author | Shadma Wahab Abdulrhman Alsayari Abdullatif Bin Muhsinah Dalia Almaghaslah Anzarul Haque Mohammad Khalid Sulaiman Mohammed Alnasser Faizul Azam Md. Sarfaraj Hussain |
| author_facet | Shadma Wahab Abdulrhman Alsayari Abdullatif Bin Muhsinah Dalia Almaghaslah Anzarul Haque Mohammad Khalid Sulaiman Mohammed Alnasser Faizul Azam Md. Sarfaraj Hussain |
| author_sort | Shadma Wahab |
| collection | DOAJ |
| description | <i>Abutilon indicum L.</i> (Malvaceae), more often referred to as Peeli booti, Kanghi, and Kakhi, is a perennial shrub found in many countries of Asia. Traditionally, this plant is used as a diuretic to treat inflammation, discomfort, urethral infections, and gout. Inflammation and pain are key topics of interest for researchers throughout the globe, since they are linked to almost every illness that could affect humans or animals. The present study was conducted to isolate the phytoconstituents from the methanolic extract of <i>Abutilon indicum</i> collected from the Bihar state Koshi river belt in India, and to evaluate the isolated phytoconstituents’ ability to reduce nociception and inflammation. Furthermore, molecular docking was performed to investigate the molecular interaction profile, with possible therapeutic targets for anti-inflammatory medicines. <i>A. indicum</i> methanolic extract yielded two novel phytocompounds identified as 5′-hydroxyhexyl n-hexadecanoate (AB-01) and n-octanoyl-β-D-glucopyranosyl-(2′-1′′)-β-D-glucopyranosyl-(2′′-1′′′)-β-D-glucopyranosyl-(2′′′-1′′′′)-β-D-glucopyranoside (AB-05), together with three previously recognized phytocompounds such as ester glucoside. All isolated molecules were tested for the efficacy of analgesic and anti-inflammatory characteristics at doses of 5 and 10 mg/kg body weight. The isolated compound’s molecular interaction profile with anti-inflammatory drug targets cyclooxygenase-2 and tumor necrosis factor-alpha possessed high potential energy in molecular docking. These findings may aid in developing anti-inflammatory and analgesic drugs from <i>A. indicum.</i> |
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| institution | Directory Open Access Journal |
| issn | 2223-7747 |
| language | English |
| last_indexed | 2024-03-09T21:17:55Z |
| publishDate | 2022-09-01 |
| publisher | MDPI AG |
| record_format | Article |
| series | Plants |
| spelling | doaj.art-7a8c5574b05746ba9465c326712cf5f12023-11-23T21:29:56ZengMDPI AGPlants2223-77472022-09-011119258310.3390/plants11192583The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and InflammationShadma Wahab0Abdulrhman Alsayari1Abdullatif Bin Muhsinah2Dalia Almaghaslah3Anzarul Haque4Mohammad Khalid5Sulaiman Mohammed Alnasser6Faizul Azam7Md. Sarfaraj Hussain8Department of Pharmacognosy, College of Pharmacy, King Khalid University, Abha 61421, Saudi ArabiaDepartment of Pharmacognosy, College of Pharmacy, King Khalid University, Abha 61421, Saudi ArabiaDepartment of Pharmacognosy, College of Pharmacy, King Khalid University, Abha 61421, Saudi ArabiaDepartment of Clinical Pharmacy, College of Pharmacy, King Khalid University, Abha 61421, Saudi ArabiaDepartment of Pharmaceutics, Buraydah College of Pharmacy and Dentistry, Buraydah P.O. Box 31717, Al-Qassim, Saudi ArabiaCollege of Pharmacy, Department of Pharmacognosy, Prince Sattam Bin Abdul Aziz University, Al Kharj 11942, Saudi ArabiaDepartment of Pharmacology and Toxicology, Unaizah College of Pharmacy, Qassim University, Unaizah 51911, Saudi ArabiaDepartment of Pharmaceutical Chemistry and Pharmacognosy, Unaizah College of Pharmacy, Qassim University, Unaizah 51911, Saudi ArabiaLord Buddha Koshi Pharmacy College, Baijanathpur, NH 107, Saharsa 852201, Bihar, India<i>Abutilon indicum L.</i> (Malvaceae), more often referred to as Peeli booti, Kanghi, and Kakhi, is a perennial shrub found in many countries of Asia. Traditionally, this plant is used as a diuretic to treat inflammation, discomfort, urethral infections, and gout. Inflammation and pain are key topics of interest for researchers throughout the globe, since they are linked to almost every illness that could affect humans or animals. The present study was conducted to isolate the phytoconstituents from the methanolic extract of <i>Abutilon indicum</i> collected from the Bihar state Koshi river belt in India, and to evaluate the isolated phytoconstituents’ ability to reduce nociception and inflammation. Furthermore, molecular docking was performed to investigate the molecular interaction profile, with possible therapeutic targets for anti-inflammatory medicines. <i>A. indicum</i> methanolic extract yielded two novel phytocompounds identified as 5′-hydroxyhexyl n-hexadecanoate (AB-01) and n-octanoyl-β-D-glucopyranosyl-(2′-1′′)-β-D-glucopyranosyl-(2′′-1′′′)-β-D-glucopyranosyl-(2′′′-1′′′′)-β-D-glucopyranoside (AB-05), together with three previously recognized phytocompounds such as ester glucoside. All isolated molecules were tested for the efficacy of analgesic and anti-inflammatory characteristics at doses of 5 and 10 mg/kg body weight. The isolated compound’s molecular interaction profile with anti-inflammatory drug targets cyclooxygenase-2 and tumor necrosis factor-alpha possessed high potential energy in molecular docking. These findings may aid in developing anti-inflammatory and analgesic drugs from <i>A. indicum.</i>https://www.mdpi.com/2223-7747/11/19/2583<i>Abutilon indicum</i>isolationanti-inflammatoryanalgesicmolecular docking |
| spellingShingle | Shadma Wahab Abdulrhman Alsayari Abdullatif Bin Muhsinah Dalia Almaghaslah Anzarul Haque Mohammad Khalid Sulaiman Mohammed Alnasser Faizul Azam Md. Sarfaraj Hussain The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation Plants <i>Abutilon indicum</i> isolation anti-inflammatory analgesic molecular docking |
| title | The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation |
| title_full | The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation |
| title_fullStr | The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation |
| title_full_unstemmed | The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation |
| title_short | The Structural, Biological, and In-Silico Profiling of Novel Capryloyl Tetra-Glucoside and Aliphatic Ester Constituents from the <i>Abutilon indicum</i> Offers New Perspectives on the Treatment of Pain and Inflammation |
| title_sort | structural biological and in silico profiling of novel capryloyl tetra glucoside and aliphatic ester constituents from the i abutilon indicum i offers new perspectives on the treatment of pain and inflammation |
| topic | <i>Abutilon indicum</i> isolation anti-inflammatory analgesic molecular docking |
| url | https://www.mdpi.com/2223-7747/11/19/2583 |
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