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Alpha-Glucosidase Inhibitory Effects of Flavonoids, Phenolic Acids and Iridoids Isolated From Vinca Soneri: In Vitro and In Silico Perspectives.
- Source :
-
Chemistry & biodiversity [Chem Biodivers] 2024 Oct; Vol. 21 (10), pp. e202401386. Date of Electronic Publication: 2024 Sep 11. - Publication Year :
- 2024
-
Abstract
- Various Vinca species have been traditionally used for their antihypertensive, sedative, and hemostatic properties, as well as for treating diabetes. In this study, some flavonoids, phenolic acids and iridoids were isolated from an endemic Vinca species, Vinca soneri for the first time. α-Glucosidase inhibitory effects of the isolates were tested and kaempferol-3-O-α-rhamnopyranosyl (1→6) β-galactopyranoside (1) was found to be the most active one with an IC <subscript>50</subscript> value of 285.73 ±7.35 μM. Enzyme kinetic assay revealed that it inhibited α-glucosidase in competitive manner. Molecular geometry of 1 was predicted and Frontier molecular orbital analysis was performed using Density Functional Theory (DFT) calculations. Molecular docking and MM-GBSA calculations predicted good fit for 1 in the enzyme active site and key interactions with the catalytic residues. As a result, current study identifies 1 as a promising competitive α-glucosidase inhibitor to be developed as a potential antidiabetic drug candidate.<br /> (© 2024 Wiley-VHCA AG, Zurich, Switzerland.)
- Subjects :
- Kinetics
Molecular Structure
Density Functional Theory
Glycoside Hydrolase Inhibitors pharmacology
Glycoside Hydrolase Inhibitors chemistry
Glycoside Hydrolase Inhibitors isolation & purification
alpha-Glucosidases metabolism
Flavonoids chemistry
Flavonoids isolation & purification
Flavonoids pharmacology
Hydroxybenzoates chemistry
Hydroxybenzoates isolation & purification
Hydroxybenzoates pharmacology
Molecular Docking Simulation
Iridoids chemistry
Iridoids pharmacology
Iridoids isolation & purification
Subjects
Details
- Language :
- English
- ISSN :
- 1612-1880
- Volume :
- 21
- Issue :
- 10
- Database :
- MEDLINE
- Journal :
- Chemistry & biodiversity
- Publication Type :
- Academic Journal
- Accession number :
- 39031506
- Full Text :
- https://doi.org/10.1002/cbdv.202401386