LC-MS based metabolite profiling of ethanol extract from the Sungkai (Peronema canescens Jack) and in silico prediction of antidiabetic activity with α-Glucosidase

Latief, Madyawati and Arum, Dewi and Nurjannah, Sofia and Tarigan, Indra Lasmana and Khatib, Alfi and Yusnaidar, Yusnaidar (2024) LC-MS based metabolite profiling of ethanol extract from the Sungkai (Peronema canescens Jack) and in silico prediction of antidiabetic activity with α-Glucosidase. Molekul, 19 (3). pp. 455-462. ISSN 19079761 E-ISSN 2503-0310

	PDF - Published Version Restricted to Repository staff only Download (301kB) | Request a copy
Preview	PDF (SCOPUS) - Supplemental Material Download (111kB) | Preview

Abstract

Sungkai (Peronema canescens Jack) is a medicinal plant in the Verbenaceae family that is known to have antidiabetic activity. The secondary metabolite content found in sungkai leaves is in the form of alkaloids, flavonoids, triterpenoids, steroids, phenolics, and saponins. This research aimed to identify the biological activity of compounds in sungkai plants as antidiabetic agents using α-glucosidase inhibitors in silico. Sungkai leaf extract with ethanol solvent was identified using a Liquid Chromatography Mass Spectrometer (LC-MS/MS). There are 15 compounds resulting from LC-MS/MS analysis which will then predict antidiabetic activity using molecular docking. Molecular docking was carried out using AutoDock Tools software and visualized with Discovery Studio. The highest scoring result obtained from the molecular docking test was the compound C13H23N6S with a free bond energy result of -7.31 and an inhibition constant value of 4.41 μM, which binds three hydrogen bonds in GLU 78, ALA 75, and GLU 198.

Item Type:	Article (Journal)
Additional Information:	Alfi Khatib is the first IIUM author. It is an international collaborative research work with Universitas Jambi in Indonesia
Uncontrolled Keywords:	In sillico, metabolite profilling, Peronema canescens
Subjects:	R Medicine > RS Pharmacy and materia medica > RS403 Materia Medica-Pharmaceutical Chemistry
Kulliyyahs/Centres/Divisions/Institutes (Can select more than one option. Press CONTROL button):	Kulliyyah of Pharmacy > Department of Pharmaceutical Chemistry Kulliyyah of Pharmacy
Depositing User:	Dr. Alfi Khatib
Date Deposited:	06 Jan 2025 11:58
Last Modified:	06 Jan 2025 11:58
URI:	http://irep.iium.edu.my/id/eprint/117406

Actions (login required)

View Item