19 Molecular Docking Analysis of Volatile Compounds from Fraction of Eichhornia crassipes Herbs Ethanol Extract As α-Glucosidase Inhibitor
Abstrak
Diabetes mellitus is a degenerative disease characterized by an increase in blood sugar (hyperglycemia).
Inhibiting it will prevent the uptake of glucose in the plasma. One of the plants that can be used
as antidiabetic is E. crassipes herbs. This research aims to know the interaction between volatile
chemical compounds from ethyl acetate fraction and ethanol fraction of ethanol extract of E. crassipes
herbs with the α-glucosidase enzyme. This study used ethanol extract of E. crassipes herbs with a
variation of ethyl acetate fraction and ethanol fraction then analyzed the fraction using GC-MS (Gas
Chromatography-Mass Spectroscopy). The ethyl acetate fraction contained 2-pyridine-propanoic
acid, alpha.-methyl-.beta.-oxo-,Ethyl ester;1-propanol-1-di; carbamic acid, methyl ester; acetic acid,
aminooxy-, hydrazide; (2R) - [2-2H2] glycine methyl ester hydrochloride. The ethanol fraction
contained semicarbazide hydrochloride; carbonic dihydrazide; hydroxy-acetaldehyde; 1-propanol-1-
di; acetic acid, and hydroxyl. The result of docking with the α-glucosidase enzyme is 2-pyridinepropanoic
acid, alpha.-methyl-.beta.-oxo-, the Ethyl ester of the ethyl acetate fraction having ΔG is
-4.14 Kcal/mol. Semicarbazide hydrochloride from the ethanol fraction has ΔG of -3.17 Kcal/mol.
Keywords: Diabetes mellitus, docking molecular, (Eichhornia crassipes (Mart.) Solms Herbs, ethyl
acetate fraction, α-glucosidase enzyme.
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DOI: https://doi.org/10.24198/ijpst.v10i1.32399
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