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Evidence-Based Complementary and Alternative Medicine
Volume 2016 (2016), Article ID 4098686, 7 pages
http://dx.doi.org/10.1155/2016/4098686
Research Article

Biological Evaluation and Docking Analysis of Daturaolone as Potential Cyclooxygenase Inhibitor

1Department of Geology, University of Swabi, Khyber Pakhtunkhwa, Anbar 23561, Pakistan
2Department of Pharmacy, University of Naples Federico II, 80131 Naples, Italy
3Institute of Chemical Sciences, University of Peshawar, Peshawar 25120, Pakistan
4H.E.J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi 75270, Pakistan
5Department of Pharmacy, Abdul Wali Khan University Mardan, Mardan 23200, Pakistan
6Department of Pharmacy, University of Salerno, Fisciano, 84084 Salerno, Italy

Received 1 October 2015; Revised 4 February 2016; Accepted 8 February 2016

Academic Editor: Bamidele Victor Owoyele

Copyright © 2016 Abdur Rauf et al. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Supplementary Material

The structural elucidation of the isolated compound was performed by spectroscopic methods (1H-NMR, 13C-NMR, HMBC, HMQC, NOESY, COSY, HREI-MS, and IR). Spectra were obtained on a Vector 22 (Bruker) Fourier transform infrared (FTIR) spectrometer, employing KBr windows with CH2Cl2 as the solvent against an air background. 1H-NMR (600 MHz) and 13C-NMR (125 MHz) spectra were registered on a Bruker Avance spectrometer. The 2D-NMR spectra were obtained on a Bruker Avance NMR spectrometer. Mass spectral information (EI and HR-EI-MS) was recorded on Jeol-JMS-HX-110 mass spectrometer and calculated in electron impact mode on Finnigan MAT-312 and MAT-95 XP; ions were given in m/z (%). Melting points of compound 1 were determined in glass capillaries tubes by Bicote melting point apparatus (Bibby Scientific limited, UK) and the UV spectra were measured in chloroform by using UV-visible recording spectrometer Model Hitachi-U-3200 (Japan). The IR spectra were recorded on FT-IR Nicolet 380 (Thermo Scientific, UK) and the single X-rays on Kappa APEXII CCD diffractometer (SADABS; Bruker, 2005).

  1. Supplementary Material