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来自尤里卡恩氏菌的(3R,4S)-3,4,8-三羟基-1,2,3,4-四氢萘-1-酮一水合物

(3R,4S)-3,4,8-Trihy-droxy-1,2,3,4-tetra-hydro-naphthalen-1-one monohydrate from Embellisia eureka.

作者信息

Ouchbani Tarik, Zouihri Hafid, Essassi El Mokhtar, Proksch Peter, Ng Seik Weng

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Jun 1;68(Pt 6):o1874. doi: 10.1107/S1600536812022623. Epub 2012 May 26.

Abstract

In the title hydrate, C(10)H(10)O(4)·H(2)O, the six-membered aliphatic ring that is fused to the benzene ring has a sofa shape, with the hy-droxy group in the 3-position (that represents the sofa back) of the aliphatic ring occupying a quasi-axial position. The hy-droxy group of the aromatic ring is hydrogen-bond donor to the carbonyl O atom; other O-H⋯O hydrogen bonds link the organic mol-ecules and the water mol-ecules into a three-dimensional network.

摘要

在标题水合物C(10)H(10)O(4)·H(2)O中,与苯环稠合的六元脂肪环呈沙发形状,脂肪环3位(代表沙发靠背)的羟基占据准轴向位置。芳环的羟基是羰基O原子的氢键供体;其他O—H⋯O氢键将有机分子和水分子连接成三维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b698/3379437/6230597508fb/e-68-o1874-fig1.jpg

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