Antispasmodic activity of carnosic acid extracted from rosmarinus officinalis: Isolation, spectroscopic characterization, DFT studies, and in silico molecular docking …

K Wei, H Louis, W Emori, PS Idante… - Journal of Molecular …, 2022 - Elsevier
This research work focuses on the isolation, spectroscopic characterization (FT-IR, UV–vis,
and NMR), density functional theory (DFT) studies, and the potential application of carnosic
acid as an antispasmodic agent drug evaluated by molecular docking with various
spasmolytic receptors proteins and the results compared with diazepam (DZP) and
toleterodine (TTD) as standard drugs. All computational calculations of the isolated and
spectroscopic determined structure was performed at the B3LYP/6–311++ G (d, p) …
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