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Crystal structure of hydro­cortisone 17-butyrate

In the title compound, C(25)H(36)O(6), the two central cyclo­hexane rings exhibit a chair conformation. The terminal cyclo­hexene and cyclo­pentane rings are in half-chair and envelope conformations (with the C atom bearing the methyl substit­uent as the flap), respectively. The methyl group of the...

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Detalles Bibliográficos
Autores principales: Zhu, Yu, Shen, Wei, Wang, Hai-li
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257404/
https://www.ncbi.nlm.nih.gov/pubmed/25553020
http://dx.doi.org/10.1107/S1600536814023903
Descripción
Sumario:In the title compound, C(25)H(36)O(6), the two central cyclo­hexane rings exhibit a chair conformation. The terminal cyclo­hexene and cyclo­pentane rings are in half-chair and envelope conformations (with the C atom bearing the methyl substit­uent as the flap), respectively. The methyl group of the butyrate chain is disordered over two orientations, with a refined occupancy ratio of 0.742 (6):0.258 (6). Intra­molecular O—H⋯O and C—H⋯O hydrogen bonds are observed. In the crystal, mol­ecules are linked by O—H⋯O hydrogen bonds into chains running parallel to the a axis.