College of Pharmacy, Kangwon National University, Chuncheon, 200-701, Korea.
Arch Pharm Res. 2012 Mar;35(4):671-81. doi: 10.1007/s12272-012-0411-5. Epub 2012 May 3.
Capillary electrophoresis (CE) and proton nuclear magnetic resonance spectroscopy ((1)H-NMR) have been used to discriminate the enantiomers of sibutramine using cyclodextrin derivatives. Possible correlation between CE and (1)H-NMR was examined. Good correlation between the (1)H-NMR shift non-equivalence data for sibutramine and the degree of enantioseparation in CE was observed. In CE study, a method of enantiomeric separation and quantitation of sibutramine was developed using enantiomeric standards. The method was based on the use of 50 mM of phosphate buffer of pH 3.0 with 10 mM of methyl-beta-cyclodextrin (M-β-CD). 0.05% of LOD, 0.2% of LOQ for S-sibutramine enantiomer was achieved, and the method was validated and applied to the quantitative determination of sibutramine enantiomers in commercial drugs. On a 600 MHz (1)H-NMR analysis, enantiomer signal separation of sibutramine was obtained by fast diastereomeric interaction with a chiral selector M-β-CD. For chiral separation and quantification, N-methyl proton peaks (at 2.18 ppm) were selected because of its being singlet and simple for understanding of diastereomeric interaction. Effects of temperature and concentration of chiral selector on enantiomer signal separation were investigated. The optimum condition was 0.5 mg/mL of sibutramine and 10 mg/mL of M-β-CD at 10°C. Distinguishment of 0.5% of S-sibutramine in R-sibutramine was found to be possible by (1)H-NMR with M-β-CD as chiral selector. Host-guest interaction between sibutramine and M-β-CD was confirmed by (1)H-NMR studies and CE studies. A Structure of the inclusion complex was proposed considering (1)H-NMR and 2D ROESY studies.
毛细管电泳 (CE) 和质子核磁共振波谱 ((1)H-NMR) 已被用于使用环糊精衍生物区分西布曲明对映异构体。检查了 CE 与 (1)H-NMR 之间的可能相关性。观察到西布曲明的 (1)H-NMR 位移非等价数据与 CE 中对映体分离程度之间存在良好的相关性。在 CE 研究中,使用对映体标准品开发了一种分离和定量西布曲明对映异构体的方法。该方法基于使用 pH 3.0 的 50 mM 磷酸盐缓冲液和 10 mM 甲基-β-环糊精 (M-β-CD)。实现了 S-西布曲明对映异构体的 LOD 为 0.05%,LOQ 为 0.2%,方法经过验证并应用于商业药物中西布曲明对映异构体的定量测定。在 600 MHz (1)H-NMR 分析中,通过与手性选择器 M-β-CD 的快速非对映相互作用获得西布曲明对映异构体的信号分离。对于手性分离和定量,选择 N-甲基质子峰(在 2.18 ppm 处),因为它是单峰且易于理解非对映相互作用。研究了温度和手性选择器浓度对对映体信号分离的影响。最佳条件为 10°C 时西布曲明浓度为 0.5 mg/mL,M-β-CD 浓度为 10 mg/mL。发现使用 M-β-CD 作为手性选择器,通过 (1)H-NMR 可以区分 0.5%的 S-西布曲明在 R-西布曲明中的存在。通过 (1)H-NMR 研究和 CE 研究证实了西布曲明和 M-β-CD 之间的主体-客体相互作用。考虑到 (1)H-NMR 和 2D ROESY 研究,提出了包含配合物的结构。