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From himachalenes to trans-himachalol: unveiling bioactivity through hemisynthesis and molecular docking analysis

Article scientifique 2023 Anglais

Résumé

Abstract In this study, we report the first total hemisynthesis of trans-himachalol sesquiterpene, a stereoisomer of the natural cis-himachalol isolated from Cedrus atlantica essential oils, from himachalenes mixture in five steps. Reactions conditions were optimized and structures of the obtained compounds were confirmed by IR, mass spectra, 1H, and 13C NMR. The synthesized compounds were investigated for potential activities on various isolated smooth muscles and against different neurotransmitters using molecular docking. The results show that the synthesized compounds display high affinities towards the active site of the protein 7B2W and the compounds exhibit promising activities on various isolated smooth muscles and against different neurotransmitters.

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Faris, A., Edder, Y., Louchachha, I., Lahcen, I., Azzaoui, K., Hammouti, B., Merzouki, M., Challioui, A., Boualy, B., Karim, A., Hanbali, G., Jodeh, S. (2023). From himachalenes to trans-himachalol: unveiling bioactivity through hemisynthesis and molecular docking analysis. https://doi.org/10.1038/s41598-023-44652-z

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Auteur(s)

Abdelmajid Faris Youssef Edder Issam Louchachha Intissar Ait Lahcen Khalil Azzaoui B. Hammouti Mohammed Merzouki Allal Challioui Brahim Boualy Abdallah Karim Ghadir Hanbali Shehdeh Jodeh

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