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半琥珀酸{2-羟基-3-[4-(2-甲氧基乙基)苯氧基]丙基}异丙铵

{2-Hydr-oxy-3-[4-(2-methoxy-ethyl)-phen-oxy]prop-yl}isopropyl-ammonium hemisuccinate.

作者信息

Bartolucci Gianluca, Bruni Bruno, Coran Silvia A, Di Vaira Massimo

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 May 23;65(Pt 6):o1364-5. doi: 10.1107/S160053680901856X.

Abstract

Metoprolol, a widely used adrenoreceptor blocking drug, is commonly administered as the succinate or tartrate salt. The structure of metoprolol succinate, C(15)H(26)NO(3) (+)·0.5C(4)H(4)O(4) (2-), is characterized by the presence of ribbons in which cations, generated by N-protonation of the metoprolol mol-ecules, are hydrogen bonded to succinate anions. The dicarboxylic acid transfers its H atoms to two metoprolol mol-ecules; the asymmetric unit contains one cation and half an anion, the latter possessing twofold rotational symmetry. There are localized nets of O-H⋯O and N-H⋯O hydrogen bonds along a ribbon, within centrosymmetric arrangements formed by pairs of metoprolol cations and pairs of anions, each of the latter contributing with one of its carboxyl groups to the localized net. This arrangement is repeated along the ribbon by the operation of the twofold axis bis-ecting the anion, as well as by the lattice translation.

摘要

美托洛尔是一种广泛使用的肾上腺素能受体阻断药物,通常以琥珀酸盐或酒石酸盐的形式给药。美托洛尔琥珀酸盐的结构为C(15)H(26)NO(3) (+)·0.5C(4)H(4)O(4) (2-),其特征在于存在条带,其中美托洛尔分子通过N-质子化产生的阳离子与琥珀酸根阴离子形成氢键。二元羧酸将其H原子转移到两个美托洛尔分子上;不对称单元包含一个阳离子和半个阴离子,后者具有二重旋转对称性。沿着条带存在O-H⋯O和N-H⋯O氢键的局部网络,这些网络存在于由美托洛尔阳离子对和阴离子对形成的中心对称排列中,每个阴离子对通过其一个羧基对局部网络做出贡献。这种排列通过平分阴离子的二重轴操作以及晶格平移沿着条带重复出现。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/22bc/2969523/9d23f2dd168d/e-65-o1364-fig1.jpg

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