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9α-Bromo analog of beclometasone dipropionate monohydrate
In the crystal structure of (8S,9R,10S,11S,13S,14S,16S,17R)-9α-bromo-11-hydroxy-10,13,16-trimethyl-3-oxo-17-[2-(propionyloxy)acetyl]-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl propionate monohydrate, C(28)H(37)BrO(7)·H(2)O, which has a 9α-Br atom in place of...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977184/ https://www.ncbi.nlm.nih.gov/pubmed/21583523 http://dx.doi.org/10.1107/S1600536809025975 |
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author | Ketuly, Kamal Aziz A. Hadi, A. Hamid Ng, Seik Weng |
author_facet | Ketuly, Kamal Aziz A. Hadi, A. Hamid Ng, Seik Weng |
author_sort | Ketuly, Kamal Aziz |
collection | PubMed |
description | In the crystal structure of (8S,9R,10S,11S,13S,14S,16S,17R)-9α-bromo-11-hydroxy-10,13,16-trimethyl-3-oxo-17-[2-(propionyloxy)acetyl]-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl propionate monohydrate, C(28)H(37)BrO(7)·H(2)O, which has a 9α-Br atom in place of the 9α-Cl atom of monohydrated beclometasone dipropionate, one six-membered ring is planar (r.m.s. deviation = 0.02 Å) owing to its 1,4-diene-3-one composition, whereas the two other six-membered rings each have a chair conformation. The organic molecule and water molecules engage in hydrogen-bonding interactions, generating a helical chain running along the c axis of the orthorhombic unit cell. |
format | Text |
id | pubmed-2977184 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29771842010-12-30 9α-Bromo analog of beclometasone dipropionate monohydrate Ketuly, Kamal Aziz A. Hadi, A. Hamid Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of (8S,9R,10S,11S,13S,14S,16S,17R)-9α-bromo-11-hydroxy-10,13,16-trimethyl-3-oxo-17-[2-(propionyloxy)acetyl]-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl propionate monohydrate, C(28)H(37)BrO(7)·H(2)O, which has a 9α-Br atom in place of the 9α-Cl atom of monohydrated beclometasone dipropionate, one six-membered ring is planar (r.m.s. deviation = 0.02 Å) owing to its 1,4-diene-3-one composition, whereas the two other six-membered rings each have a chair conformation. The organic molecule and water molecules engage in hydrogen-bonding interactions, generating a helical chain running along the c axis of the orthorhombic unit cell. International Union of Crystallography 2009-07-11 /pmc/articles/PMC2977184/ /pubmed/21583523 http://dx.doi.org/10.1107/S1600536809025975 Text en © Ketuly et al. 2009 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers Ketuly, Kamal Aziz A. Hadi, A. Hamid Ng, Seik Weng 9α-Bromo analog of beclometasone dipropionate monohydrate |
title | 9α-Bromo analog of beclometasone dipropionate monohydrate |
title_full | 9α-Bromo analog of beclometasone dipropionate monohydrate |
title_fullStr | 9α-Bromo analog of beclometasone dipropionate monohydrate |
title_full_unstemmed | 9α-Bromo analog of beclometasone dipropionate monohydrate |
title_short | 9α-Bromo analog of beclometasone dipropionate monohydrate |
title_sort | 9α-bromo analog of beclometasone dipropionate monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977184/ https://www.ncbi.nlm.nih.gov/pubmed/21583523 http://dx.doi.org/10.1107/S1600536809025975 |
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