hrcak mascot   Srce   HID

Izvorni znanstveni članak
https://doi.org/10.5562/cca3140

Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]

Maja Marasović ; Faculty of Chemistry and Technology, University of Split, Ruđera Boškovića 35, 21000 Split, Croatia
Tea Marasović ; Faculty of Electrical Engineering, Mechanical Engineering and Naval Architecture, University of Split, Ruđera Boškovića 32, 21000 Split, Croatia
Borivoj Galić ; Faculty of Science, University of Sarajevo, Zmaja od Bosne 33-35, 71000 Sarajevo, Bosnia and Herzegovina
Mladen Miloš ; Faculty of Chemistry and Technology, University of Split, Ruđera Boškovića 35, 21000 Split, Croatia

Puni tekst: engleski, pdf (5 MB) str. 155-161 preuzimanja: 732* citiraj
APA 6th Edition
Marasović, M., Marasović, T., Galić, B. i Miloš, M. (2017). Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]. Croatica Chemica Acta, 90 (2), 155-161. https://doi.org/10.5562/cca3140
MLA 8th Edition
Marasović, Maja, et al. "Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]." Croatica Chemica Acta, vol. 90, br. 2, 2017, str. 155-161. https://doi.org/10.5562/cca3140. Citirano 21.09.2021.
Chicago 17th Edition
Marasović, Maja, Tea Marasović, Borivoj Galić i Mladen Miloš. "Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]." Croatica Chemica Acta 90, br. 2 (2017): 155-161. https://doi.org/10.5562/cca3140
Harvard
Marasović, M., et al. (2017). 'Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]', Croatica Chemica Acta, 90(2), str. 155-161. https://doi.org/10.5562/cca3140
Vancouver
Marasović M, Marasović T, Galić B, Miloš M. Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]. Croatica Chemica Acta [Internet]. 2017 [pristupljeno 21.09.2021.];90(2):155-161. https://doi.org/10.5562/cca3140
IEEE
M. Marasović, T. Marasović, B. Galić i M. Miloš, "Quantum Chemical and Biochemical Study on Antioxidant Properties of Halogenated Boroxine K2[B3O3F4OH]", Croatica Chemica Acta, vol.90, br. 2, str. 155-161, 2017. [Online]. https://doi.org/10.5562/cca3140

Sažetak
The boron heterocyclic compound dipottasium trioxohydroxytetraflourotriborate, K2[B3O3F4OH] has been listed as a promising new therapeutic for the epidermal changes treatment. In order to elucidate its free radical scavenging activity, several appropriate thermodynamic molecular descriptors were calculated with the help of quantum-chemistry methods and their values were compared with the data obtained for ascorbic acid, trimethlyboroxine and trimethoxyboroxine. Considering the results, it may be suggested that the single electron transfer followed by proton transfer (SET-PT) is more favourable reaction pathway than hydrogen atom transfer (HAT) for the halogenated boroxine K2[B3O3F4OH]. Experimental support is provided by evaluating the in-vitro antioxidant activity of the investigated compounds in terms of their ferric-reducing antioxidant power (FRAP). Our study reveals that all three examined boroxines are extremely weak antioxidants.

Creative Commons License This work is licensed under a Creative Commons Attribution 4.0 International License.

Ključne riječi
halogenated boroxine; molecular modelling; antioxidant activity; reaction mechanism; FRAP

Hrčak ID: 184170

URI
https://hrcak.srce.hr/184170

Posjeta: 1.055 *