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酚类和脂肪酸对枯草芽孢杆菌孢子萌发的定量构效关系

Quantitative structure-inhibitory activity relationships of phenols and fatty acids for Bacillus subtilis spore germination.

作者信息

Yasuda Y, Tochikubo K, Hachisuka Y, Tomida H, Ikeda K

出版信息

J Med Chem. 1982 Mar;25(3):315-20. doi: 10.1021/jm00345a016.

Abstract

Phenols and fatty acids were found to inhibit L-alanine-initiated germination of Bacillus subtilis spores without altering their heat resistance. Inhibitory effect was defined as the concentration necessary to cause 50% inhibition of the germination rate. The quantitative structure-inhibitory activity relationships for 39 phenols and 7 fatty acids were analyzed. The pH dependency of inhibition showed that the nonionized form of the molecule was responsible for inhibition. Hydrophobicity, which was expressed by the partition coefficient or the distribution coefficient of the compounds, was important for inhibition. In addition to hydrophobicity, the electronic effect, which was expressed by the dissociation constant, played a partial role in phenols. The correlation equation of the fatty acids was similar to those of the alcohols and other hydrophobic compounds, which had been reported earlier. That of the phenols, however, appeared to be different, indicating a different and more complex mechanism of inhibition. The type of inhibition by both compounds was mixed rather than competitive or noncompetitive.

摘要

研究发现,酚类和脂肪酸可抑制枯草芽孢杆菌孢子由L-丙氨酸引发的萌发,且不改变其耐热性。抑制作用定义为导致萌发率抑制50%所需的浓度。分析了39种酚类和7种脂肪酸的定量构效关系。抑制作用的pH依赖性表明,分子的非离子化形式起抑制作用。由化合物的分配系数或分布系数表示的疏水性对抑制作用很重要。除疏水性外,由解离常数表示的电子效应在酚类中起部分作用。脂肪酸的相关方程与之前报道的醇类和其他疏水化合物的相似。然而,酚类的相关方程似乎不同,表明其抑制机制不同且更为复杂。这两种化合物的抑制类型均为混合型,而非竞争性或非竞争性。

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