Blagojević Polina D, Radulović Niko S, Skropeta Danielle
Faculty of Science and Mathematics, University of Niš, Višegradska 33, RS-18000 Niš, (phone: +381-62-8049210; fax: +381-18-533014).
School of Chemistry, University of Wollongong, 2515, NSW, Australia.
Chem Biodivers. 2015 Aug;12(8):1237-55. doi: 10.1002/cbdv.201400288.
The plant volatile profile and the essential-oil chemical composition change during the storage of plant material. The objective of this study was to develop a mathematical model able to predict, explain, and quantify these changes. Mathematical equations, derived under the assumption that the essential oil contained within plant material could be treated as an ideal solution (Raoult's law), were applied for tracking of postharvest changes in the volatile profile of Artemisia absinthium L. (the essential oils were analyzed by GC-FID and GC/MS). Starting from a specific chemical composition of an essential-oil sample obtained from plant material after a short drying period (typically 5-10 d), and by using the equations derived from this model, one could easily predict evaporation-induced changes in the volatile profile of the plant material. Based on the composition of the essential-oil sample obtained after a given storage time t, it is possible to identify those components that were involved in chemical reactions, both as reactants and possible products. The established model even allowed the recognition of pairs of transformation, i.e., 'daughter' products and their 'parent' compounds. The obtained results highlight that the essential-oil composition is highly dependent on the storage period of any plant material and urges caution in different types of phytochemical studies, especially chemotaxonomic ones, or practical application.
植物材料在储存过程中,其挥发性成分和精油化学成分会发生变化。本研究的目的是建立一个能够预测、解释和量化这些变化的数学模型。在假设植物材料中所含精油可视为理想溶液(拉乌尔定律)的前提下推导得出的数学方程,被用于追踪苦艾(Artemisia absinthium L.)收获后挥发性成分的变化(通过气相色谱 - 火焰离子化检测器和气相色谱/质谱联用仪分析精油)。从经过短时间干燥(通常为5 - 10天)的植物材料中获得的精油样品的特定化学成分出发,并使用从该模型推导得出的方程,人们可以轻松预测植物材料挥发性成分因蒸发而引起的变化。根据在给定储存时间t后获得的精油样品的组成,有可能识别出参与化学反应的那些成分,包括反应物和可能的产物。所建立的模型甚至能够识别转化对,即“子”产物及其“母”化合物。所得结果表明,精油组成高度依赖于任何植物材料的储存期,并促使在不同类型的植物化学研究中,尤其是化学分类学研究或实际应用中要谨慎行事。