28-O-Acetyl-3-O”——(prop-2-enoyl)桦木醇

IF 0.6 Q4 CHEMISTRY, ORGANIC

Molbank Pub Date : 2023-07-14 DOI:10.3390/m1696

Ewa Bębenek, Elwira Chrobak, Monika Kadela-Tomanek

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引用次数: 0

摘要

28乙酰化桦木蛋白是合成具有生物活性的3-或3,28-取代桦木蛋白衍生物的良好起始化合物。在Steglich酯化条件下，28乙酰基槟榔林与丙烯酸反应的最终产物产生了新的3-烯基槟榔林衍生物。基于NMR、IR、EI-MS和HRMS光谱的分析来确认所获得的化合物的结构。使用计算机模拟方法计算了与吸收和分布相关的新槟榔衍生物的选定药代动力学参数。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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28-O-Acetyl-3-O′-(prop-2-enoyl)betulin

28-Acetylbetulin is a good starting compound for the synthesis of 3- or 3,28-substituted betulin derivatives with biological activity. The final product of the reaction of 28-acetylbetulin and acrylic acid under Steglich esterification conditions produced a new 3-alkenyl betulin derivative. The structure of the obtained compound was confirmed based on the analysis of NMR, IR, EI MS, and HRMS spectra. Selected pharmacokinetic parameters related to the absorption and distribution were calculated for the new betulin derivative using in silico methods.

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来源期刊

Molbank Chemistry-Physical and Theoretical Chemistry

CiteScore

0.70

自引率

33.30%

发文量

174

审稿时长

11 weeks

期刊介绍： •organic synthesis •biosynthesis •extraction and purification •natural product derivatives •structural elucidation (X-ray crystallography, NMR, etc.)