<HashMap><database>biostudies-literature</database><scores/><additional><omics_type>Unknown</omics_type><volume>73(Pt 11)</volume><submitter>Piccialli V</submitter><pubmed_abstract>The title compound, C&lt;sub>31&lt;/sub>H&lt;sub>48&lt;/sub>O&lt;sub>6&lt;/sub>, is a polyoxygenated ep-oxy steroid obtained by a multi-step synthesis involving oxidation of 7-de-hydro-cholesterol. It crystallizes in the &lt;i>P&lt;/i>2&lt;sub>1&lt;/sub>2&lt;sub>1&lt;/sub>2&lt;sub>1&lt;/sub> space group; however, the absolute structure of the molecule in the crystal could not be determined by resonant scattering. The configuration at the C5 and C6 positions is in both cases of the α-type, as is that of the C atoms of the ep-oxy ring. Mol-ecules in the crystal form chains parallel to the &lt;i>b&lt;/i> axis by hydrogen bonding between O-H donors and carbonyl O-atom acceptors. Some atoms of the alkyl chain are disordered over two orientations, with a refined occupancy ratio of 0.511 (10):0.489 (10).</pubmed_abstract><journal>Acta crystallographica. Section E, Crystallographic communications</journal><pagination>1603-1606</pagination><full_dataset_link>https://www.ebi.ac.uk/biostudies/studies/S-EPMC5683473</full_dataset_link><repository>biostudies-literature</repository><pubmed_title>Crystal structure of an ep-oxy-sterol: 9α,11α-ep-oxy-5α-cholest-7-ene-3β,5,6α-triol 3,6-di-acetate.</pubmed_title><pmcid>PMC5683473</pmcid><pubmed_authors>Tuzi A</pubmed_authors><pubmed_authors>Piccialli V</pubmed_authors><pubmed_authors>Centore R</pubmed_authors></additional><is_claimable>false</is_claimable><name>Crystal structure of an ep-oxy-sterol: 9α,11α-ep-oxy-5α-cholest-7-ene-3β,5,6α-triol 3,6-di-acetate.</name><description>The title compound, C&lt;sub>31&lt;/sub>H&lt;sub>48&lt;/sub>O&lt;sub>6&lt;/sub>, is a polyoxygenated ep-oxy steroid obtained by a multi-step synthesis involving oxidation of 7-de-hydro-cholesterol. It crystallizes in the &lt;i>P&lt;/i>2&lt;sub>1&lt;/sub>2&lt;sub>1&lt;/sub>2&lt;sub>1&lt;/sub> space group; however, the absolute structure of the molecule in the crystal could not be determined by resonant scattering. The configuration at the C5 and C6 positions is in both cases of the α-type, as is that of the C atoms of the ep-oxy ring. Mol-ecules in the crystal form chains parallel to the &lt;i>b&lt;/i> axis by hydrogen bonding between O-H donors and carbonyl O-atom acceptors. Some atoms of the alkyl chain are disordered over two orientations, with a refined occupancy ratio of 0.511 (10):0.489 (10).</description><dates><release>2017-01-01T00:00:00Z</release><publication>2017 Nov</publication><modification>2025-04-18T19:02:52.983Z</modification><creation>2019-03-27T03:01:41Z</creation></dates><accession>S-EPMC5683473</accession><cross_references><pubmed>29152333</pubmed><doi>10.1107/S2056989017013391</doi></cross_references></HashMap>