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Unravelling the Distribution of Secondary Metabolites in Olea europaea L.: Exhaustive Characterization of Eight Olive-Tree Derived Matrices by Complementary Platforms (LC-ESI/APCI-MS and GC-APCI-MS)

机译:阐明油橄榄中次生代谢产物的分布:通过互补平台(LC-ESI / APCI-MS和GC-APCI-MS)对八种橄榄树衍生基质的详尽表征

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摘要

In order to understand the distribution of the main secondary metabolites found in Olea europaea L., eight different samples (olive leaf, stem, seed, fruit skin and pulp, as well as virgin olive oil, olive oil obtained from stoned and dehydrated fruits and olive seed oil) coming from a Picudo cv. olive tree were analyzed. All the experimental conditions were selected so as to assure the maximum coverage of the metabolome of the samples under study within a single run. The use of LC and GC with high resolution MS (through different ionization sources, ESI and APCI) and the annotation strategies within MetaboScape 3.0 software allowed the identification of around 150 compounds in the profiles, showing great complementarity between the evaluated methodologies. The identified metabolites belonged to different chemical classes: triterpenic acids and dialcohols, tocopherols, sterols, free fatty acids, and several sub-types of phenolic compounds. The suitability of each platform and polarity (negative and positive) to determine each family of metabolites was evaluated in-depth, finding, for instance, that LC-ESI-MS (+) was the most efficient choice to ionize phenolic acids, secoiridoids, flavonoids and lignans and LC-APCI-MS was very appropriate for pentacyclic triterpenic acids (MS (−)) and sterols and tocopherols (MS (+)). Afterwards, a semi-quantitative comparison of the selected matrices was carried out, establishing their typical features (e.g., fruit skin was pointed out as the matrix with the highest relative amounts of phenolic acids, triterpenic compounds and hydroxylated fatty acids, and seed oil was distinctive for its high relative levels of acetoxypinoresinol and tocopherols).
机译:为了了解在油橄榄中发现的主要次要代谢产物的分布,共有八种不同样品(橄榄叶,茎,种子,果皮和果肉,以及初榨橄榄油,从去核和脱水的水果中提取的橄榄油和橄榄籽油)来自Picudo简历。橄榄树进行了分析。选择所有实验条件,以确保在一次运行中最大程度覆盖所研究样品的代谢组。 LC和GC与高分辨率MS(通过不同的电离源,ESI和APCI)以及MetaboScape 3.0软件中的注释策略结合使用,可识别分布图中约150种化合物,显示出所评估方法之间的巨大互补性。鉴定出的代谢物属于不同的化学类别:三萜酸和二元醇,生育酚,固醇,游离脂肪酸以及酚类化合物的几种亚型。深入评估了每种平台和极性(阴性和阳性)确定每种代谢产物家族的适用性,例如,发现LC-ESI-MS(+)是使酚酸,类硒化物电离的最有效选择,类黄酮和木脂素以及LC-APCI-MS非常适合用于五环三萜酸(MS(-))和固醇和生育酚(MS(+))。之后,对所选基质进行了半定量比较,确定了它们的典型特征(例如,指出果皮是酚酸,三萜类化合物和羟基化脂肪酸相对含量最高的基质,因其乙酰氧基松脂醇和生育酚的相对含量较高而特别)。

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