The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil
Аутори
Aćimović, Milica G.Pezo, Lato
Stanković-Jeremić, Jovana
Todosijević, Marina
Rat, Milica
Tešević, Vele
Cvetković, Mirjana
Чланак у часопису (Објављена верзија)
Метаподаци
Приказ свих података о документуАпстракт
In the essential oil of yarrow (Achillea millefolium L. sensu lato) collected from natural population on Mt. Rtanj (Serbia) and distilled by Clevenger apparatus 104 compounds were detected, and
the most abundant were camphor (9.8%), caryophyllene oxide (6.5%), terpinen-4-ol (6.3%) and 1,8-
cineole (5.6%). The quantitative structure-retention relationship (QSRR) model was employed to predict the retention indices, using four molecular descriptors selected by factor analysis and a genetic
algorithm. The coefficients of determination reached the value of 0.862, demonstrating that this model could be used for prediction purposes.
Кључне речи:
Achillea millefolium L. / retention indices / molecular descriptors / factor analysis / genetic algorithm / coefficients of determinationИзвор:
Acta periodica technologica, 2021, 52, 123-132Издавач:
- University of Novi Sad, Faculty of Technology
Финансирање / пројекти:
Колекције
Институција/група
Hemijski fakultet / Faculty of ChemistryTY - JOUR AU - Aćimović, Milica G. AU - Pezo, Lato AU - Stanković-Jeremić, Jovana AU - Todosijević, Marina AU - Rat, Milica AU - Tešević, Vele AU - Cvetković, Mirjana PY - 2021 UR - http://cherry.chem.bg.ac.rs/handle/123456789/5016 AB - In the essential oil of yarrow (Achillea millefolium L. sensu lato) collected from natural population on Mt. Rtanj (Serbia) and distilled by Clevenger apparatus 104 compounds were detected, and the most abundant were camphor (9.8%), caryophyllene oxide (6.5%), terpinen-4-ol (6.3%) and 1,8- cineole (5.6%). The quantitative structure-retention relationship (QSRR) model was employed to predict the retention indices, using four molecular descriptors selected by factor analysis and a genetic algorithm. The coefficients of determination reached the value of 0.862, demonstrating that this model could be used for prediction purposes. PB - University of Novi Sad, Faculty of Technology T2 - Acta periodica technologica T1 - The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil IS - 52 SP - 123 EP - 132 DO - 10.2298/APT2152123A ER -
@article{ author = "Aćimović, Milica G. and Pezo, Lato and Stanković-Jeremić, Jovana and Todosijević, Marina and Rat, Milica and Tešević, Vele and Cvetković, Mirjana", year = "2021", abstract = "In the essential oil of yarrow (Achillea millefolium L. sensu lato) collected from natural population on Mt. Rtanj (Serbia) and distilled by Clevenger apparatus 104 compounds were detected, and the most abundant were camphor (9.8%), caryophyllene oxide (6.5%), terpinen-4-ol (6.3%) and 1,8- cineole (5.6%). The quantitative structure-retention relationship (QSRR) model was employed to predict the retention indices, using four molecular descriptors selected by factor analysis and a genetic algorithm. The coefficients of determination reached the value of 0.862, demonstrating that this model could be used for prediction purposes.", publisher = "University of Novi Sad, Faculty of Technology", journal = "Acta periodica technologica", title = "The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil", number = "52", pages = "123-132", doi = "10.2298/APT2152123A" }
Aćimović, M. G., Pezo, L., Stanković-Jeremić, J., Todosijević, M., Rat, M., Tešević, V.,& Cvetković, M.. (2021). The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil. in Acta periodica technologica University of Novi Sad, Faculty of Technology.(52), 123-132. https://doi.org/10.2298/APT2152123A
Aćimović MG, Pezo L, Stanković-Jeremić J, Todosijević M, Rat M, Tešević V, Cvetković M. The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil. in Acta periodica technologica. 2021;(52):123-132. doi:10.2298/APT2152123A .
Aćimović, Milica G., Pezo, Lato, Stanković-Jeremić, Jovana, Todosijević, Marina, Rat, Milica, Tešević, Vele, Cvetković, Mirjana, "The quantitative structure-retention relationship of the gc-ms profile of yarrow essential oil" in Acta periodica technologica, no. 52 (2021):123-132, https://doi.org/10.2298/APT2152123A . .