1.Identification of α-glucosidase inhibitors from Clinacanthus nutans leaf extract using liquid chromatography-mass spectrometry-based metabolomics and protein-ligand interaction with molecular docking
Murugesu SUGANYA ; Ibrahim ZALIKHA ; Ahmed Uddin QAMAR ; Uzir Fathamah BISHA ; Nik Idris Nik Yusoff ; Perumal VIKNESWARI ; Abas FARIDAH ; Shaari KHOZIRAH ; Khatib ALFI
Journal of Pharmaceutical Analysis 2019;9(2):91-99
The present study used in vitro and in silico techniques, as well as the metabolomics approach to char-acterise α-glucosidase inhibitors from different fractions of Clinacanthus nutans. C. nutans is a medicinal plant belonging to the Acanthaceae family, and is traditionally used to treat diabetes in Malaysia. n-Hexane, n-hexane: ethyl acetate (1:1, v/v), ethyl acetate, ethyl acetate: methanol (1:1, v/v), and methanol fractions were obtained via partitioning of the 80% methanolic crude extract. The in vitro α-glucosidase inhibitory activity was analyzed using all the fractions collected, followed by profiling of the metabolites using liquid chromatography combined with mass spectrometry. The partial least square (PLS) statistical model was developed using the SIMCA P +14.0 software and the following four inhibitors were obtained:(1) 4,6,8-Megastigmatrien-3-one; (2) N-Isobutyl-2-nonen-6,8-diynamide; (3) 1′,2′-bis(acetyloxy)-3′,4′-didehydro-2′-hydro-β, ψ-carotene; and (4) 22-acetate-3-hydroxy-21-(6-methyl-2,4-octadienoate)-olean-12-en-28-oic acid. The in silico study performed via molecular docking with the crystal structure of yeast isomaltase (PDB code: 3A4A) involved a hydrogen bond and some hydrophobic interactions be-tween the inhibitors and protein. The residues that interacted include ASN259, HID295, LYS156, ARG335, and GLY209 with a hydrogen bond, while TRP15, TYR158, VAL232, HIE280, ALA292, PRO312, LEU313, VAL313, PHE314, ARG315, TYR316, VAL319, and TRP343 with other forms of bonding.
2.A Review of Cosmos caudatus as A Promising Antidiabetic Plant
Suganya Murugesu ; Vikneswari Perumal ; Tavamani Balan ; Sharon Fatinathan ; Puvana Devi Selvarajoo ; Maryam Anis Binti Rozali ; Noor Izati Abd Aziz
Malaysian Journal of Medicine and Health Sciences 2020;16(No.4):333-343
Cosmos caudatus Kunth is an edible plant commonly known for its beneficial medicinal effects on human health and
traditionally used to treat various health conditions, including diabetes. This review summarizes the current state of
knowledge about this plant, to provide some basic information about this herb that reflects its antidiabetic potential
through multiple mechanisms. Currently, available evidence suggests that C. caudatus possess some pharmacological effects, including anti-inflammatory, antimicrobial, the formation of healthy bone and regulation of blood
pressure and glucose levels. The review summarized the antidiabetic activity and its significant phytoconstituents in
C. caudatus