Feitosa Bruna de Souza, Ferreira Oberdan Oliveira, Franco Celeste de Jesus Pereira, Karakoti Himani, Kumar Ravendra, Cascaes Marcia Moraes, Jawarkar Rahul D, Mali Suraj N, Cruz Jorddy Neves, de Menezes Ilmarina Campos, de Oliveira Mozaniel Santana, de Aguiar Andrade Eloisa Helena
School of Chemistry, Federal University of Pará, Rua Augusto Corrêa S/N, Guamá, Belém 66075-900, PA, Brazil.
Graduate Program in Biodiversity and Biotechnology-Rede Bionorte, Federal University of Pará, Rua Augusto Corrêa S/N, Guamá, Belém 66075-900, PA, Brazil.
Molecules. 2024 Feb 21;29(5):947. doi: 10.3390/molecules29050947.
The essential oils and aroma derived from the leaves (L), stems (St), and spikes (s) of L. cv. Guajarina were extracted; the essential oils were extracted using hydrodistillation (HD), and steam distillation (SD), and the aroma was obtained by simultaneous distillation and extraction (SDE). Chemical constituents were identified and quantified using GC/MS and GC-FID. Preliminary biological activity was assessed by determining the toxicity against Leach larvae, calculating mortality rates, and determining lethal concentration values (LC). The predominant compounds in essential oil samples included α-pinene (0-5.6%), β-pinene (0-22.7%), limonene (0-19.3%), 35 linalool (0-5.3%), δ-elemene (0-10.1%), β-caryophyllene (0.5-21.9%), γ-elemene (7.5-33.9%), and curzerene (6.9-31.7%). Multivariate analysis, employing principal component analysis (PCA) and hierarchical cluster analysis (HCA), revealed three groups among the identified classes and two groups among individual compounds. The highest antioxidant activity was found for essential oils derived from the leaves (167.9 41 mg TE mL). Larvicidal potential against was observed in essential oils obtained from the leaves (LC50 6.40 μg mL) and spikes (LC 6.44 μg mL). The in silico studies demonstrated that the main compounds can interact with acetylcholinesterase, thus showing the potential molecular interaction responsible for the toxicity of the essential oil in .
提取了来自瓜贾里纳罗勒(L. cv. Guajarina)叶片(L)、茎(St)和穗状花序(s)的精油和香气;精油采用水蒸馏法(HD)和水蒸气蒸馏法(SD)提取,香气通过同时蒸馏萃取法(SDE)获得。使用气相色谱/质谱联用仪(GC/MS)和气相色谱-火焰离子化检测器(GC-FID)对化学成分进行鉴定和定量。通过测定对利什曼原虫幼虫的毒性、计算死亡率以及确定致死浓度值(LC)来评估初步的生物活性。精油样品中的主要化合物包括α-蒎烯(0 - 5.6%)、β-蒎烯(0 - 22.7%)、柠檬烯(0 - 19.3%)、芳樟醇(0 - 5.3%)、δ-榄香烯(0 - 10.1%)、β-石竹烯(0.5 - 21.9%)、γ-榄香烯(7.5 - 33.9%)和莪术烯(6.9 - 31.7%)。采用主成分分析(PCA)和层次聚类分析(HCA)的多变量分析揭示了已鉴定类别中的三组以及单个化合物中的两组。发现叶片来源的精油具有最高的抗氧化活性(167.9±41 mg TE/mL)。在叶片(LC50 6.40 μg/mL)和穗状花序(LC50 6.44 μg/mL)获得的精油中观察到了对利什曼原虫的杀幼虫潜力。计算机模拟研究表明,主要化合物可与乙酰胆碱酯酶相互作用,从而显示出精油对利什曼原虫毒性的潜在分子相互作用。