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Herein, an integral method consisting of chemical kinetics, multi-spectroscopy assay and molecular simulations was used to research the structure-activity relationship and connection system of flavonoids and AG. As a result, a small amount of flavonoids was discovered to present exemplary inhibitory task on AG, such as for example 3, 5, 6, 8, 10, 17, 19, 21, 22 and 34. Additional evaluation of this structure-activity relationship illustrated that hydroxylation at the positions C