白莲子乙醇提取物挥发性组分特征、抗氧化特性及分子对接。

IF 4.2 2区 化学 Q2 BIOCHEMISTRY & MOLECULAR BIOLOGY
Melanie Ochoa-Ocampo, Nina Espinosa de Los Monteros-Silva, Jefferson V Pastuña-Fasso, Juan Diego Sacoto, María Cristina Peñuela-Mora, Gerardo Casanola-Martin, José R Almeida, Karel Diéguez-Santana, Noroska G S Mogollón
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引用次数: 0

摘要

抗氧化剂是具有多种用途的重要化合物,药用植物是这些生物分子的天然来源。菲罗丹(Philodendron heleniae)是厄瓜多尔亚马逊地区的一种原生物种,属于以其传统治疗用途而闻名的属。从一些毛竹属植物的茎和根中提取的提取物已被广泛用于治疗压力、膀胱疾病和蛇咬伤,强调了它们的药用潜力。本研究主要研究了海蓝草醇提物的挥发性成分、抗氧化性能及分子对接,以期拓展其应用领域。植物化学分析显示其富含单宁、酚类化合物、类黄酮和萜类化合物。抗氧化试验(ABTS和DPPH)表明提取物具有很强的自由基清除能力,与标准Trolox相当。GC-MS分析鉴定出48种挥发性和半挥发性代谢物,主要是酚类化合物、萜类化合物和类脂分子。将粗乙醇提取物分成水馏分和乙醇馏分,简化了下游分析步骤,便于鉴定和评价丰度较高的抗氧化剂相关代谢物。分子对接支持了这些发现,强调了豆甾醇和去氨甾醇与过氧化氢酶的强结合亲和力,过氧化氢酶是一种减少氧化应激的关键酶。这些结果表明,在强调保护厄瓜多尔生物多样性及其生物活性资源的重要性的同时,海芽孢杆菌是一种具有潜在制药应用前景的天然抗氧化剂来源。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Volatile Compositional Profile, Antioxidant Properties, and Molecular Docking of Ethanolic Extracts from Philodendron heleniae.

Antioxidants are essential compounds with diverse applications, and medicinal plants are a natural source of these biomolecules. Philodendron heleniae, a species native to the Ecuadorian Amazon, belongs to a genus renowned for its traditional therapeutic uses. Extracts from the stems and roots of several Philodendron species have been widely used to treat stress, bladder disorders, and snakebite wounds, underscoring their medicinal potential. This study investigates the volatile composition, antioxidant properties, and molecular docking of ethanolic extracts from P. heleniae, aiming to expand its applications. Phytochemical analysis revealed a rich profile of tannins, phenolic compounds, flavonoids, and terpenoids. Antioxidant assays (ABTS and DPPH) demonstrated the extract's strong free radical scavenging capacity, comparable to the standard Trolox. GC-MS analysis identified 48 volatile and semi-volatile metabolites, predominantly phenolic compounds, terpenoids, and lipid-like molecules. Fractionation of the crude ethanolic extract into aqueous and ethanolic fractions simplifies the downstream analytical steps and facilitates the identification and the evaluation of the higher abundance of antioxidant-related metabolites. Molecular docking supported these findings, highlighting strong binding affinities of stigmasterol and desmosterol to catalase, an enzyme critical for reducing oxidative stress. These results position P. heleniae as a promising source of natural antioxidants with potential pharmaceutical applications, while emphasizing the importance of conserving Ecuador's biodiversity and its bioactive resources.

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来源期刊
Molecules
Molecules 化学-有机化学
CiteScore
7.40
自引率
8.70%
发文量
7524
审稿时长
1.4 months
期刊介绍: Molecules (ISSN 1420-3049, CODEN: MOLEFW) is an open access journal of synthetic organic chemistry and natural product chemistry. All articles are peer-reviewed and published continously upon acceptance. Molecules is published by MDPI, Basel, Switzerland. Our aim is to encourage chemists to publish as much as possible their experimental detail, particularly synthetic procedures and characterization information. There is no restriction on the length of the experimental section. In addition, availability of compound samples is published and considered as important information. Authors are encouraged to register or deposit their chemical samples through the non-profit international organization Molecular Diversity Preservation International (MDPI). Molecules has been launched in 1996 to preserve and exploit molecular diversity of both, chemical information and chemical substances.
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