Suppr超能文献

(4R*,4aS*,4bS*,5R*,10aR*)-4-羟基-4a,5-二甲基-2-(丙烷-2-基)-1,4,4a,4b,5,6,7,8,10,10a-十氢菲-1-酮

(4R*,4aS*,4bS*,5R*,10aR*)-4-Hy-droxy-4a,5-dimethyl-2-(propan-2-yl)-1,4,4a,4b,5,6,7,8,10,10a-deca-hydro-phenan-thren-1-one.

作者信息

Caracelli Ignez, Zukerman-Schpector Julio, Machado André T Lousada, Brocksom Timothy J, Ferreira M Lúcia, Tiekink Edward R T

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3338. doi: 10.1107/S1600536811048008. Epub 2011 Nov 16.

Abstract

In the title compound, C(19)H(28)O(2), the A ring adopts a chair conformation. Both the B and C rings adopt envelope conformations with the C atoms common to both rings and adjacent to the carbonyl and hydroxyl groups, respectively, lying 0.604 (3) and 0.634 (3) Å out of the mean planes defined by the remaining five C atoms of rings B and C, respectively (r.m.s. deviations = 0.0100 and 0.0157 Å, respectively). The formation of linear supra-molecular C(7) chains along the a axis mediated by hy-droxy-O-H⋯O(carbon-yl) hydrogen bonds is the most prominent feature of the crystal packing.

摘要

在标题化合物C(19)H(28)O(2)中,A环呈椅式构象。B环和C环均呈信封式构象,两个环共有的且分别与羰基和羟基相邻的C原子,相对于由环B和环C其余五个C原子所定义的平均平面,分别偏离0.604 (3) Å和0.634 (3) Å(均方根偏差分别为0.0100 Å和0.0157 Å)。由羟基O—H⋯O(羰基)氢键介导沿a轴形成线性超分子C(7)链是晶体堆积的最显著特征。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fb8f/3238985/425ddea5a3f5/e-67-o3338-fig1.jpg

文献AI研究员

20分钟写一篇综述,助力文献阅读效率提升50倍。

立即体验

用中文搜PubMed

大模型驱动的PubMed中文搜索引擎

马上搜索

文档翻译

学术文献翻译模型,支持多种主流文档格式。

立即体验