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Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol
The title compound (common name: sclaral), C(16)H(28)O(2), is a sclareolide derivative, which was synthesized from sclareolide itself. In the molecule, the two six-membered rings, A and B, of the labdane skeleton adopt chair conformations and the five-membered O-containing heterocyclic ring C displ...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647384/ https://www.ncbi.nlm.nih.gov/pubmed/26594436 http://dx.doi.org/10.1107/S2056989015016370 |
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author | Shi, Xin-Wei Li, Sheng-Kun Li, Dang-Dang Lu, Qiang-Qiang |
author_facet | Shi, Xin-Wei Li, Sheng-Kun Li, Dang-Dang Lu, Qiang-Qiang |
author_sort | Shi, Xin-Wei |
collection | PubMed |
description | The title compound (common name: sclaral), C(16)H(28)O(2), is a sclareolide derivative, which was synthesized from sclareolide itself. In the molecule, the two six-membered rings, A and B, of the labdane skeleton adopt chair conformations and the five-membered O-containing heterocyclic ring C displays an envelope conformation, with the methine C atom of the fused C—C bond as the flap. In the crystal, molecules are linked by O—H⋯O hydrogen bonds, forming chains propagating along [100]. |
format | Online Article Text |
id | pubmed-4647384 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-46473842015-11-20 Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol Shi, Xin-Wei Li, Sheng-Kun Li, Dang-Dang Lu, Qiang-Qiang Acta Crystallogr E Crystallogr Commun Data Reports The title compound (common name: sclaral), C(16)H(28)O(2), is a sclareolide derivative, which was synthesized from sclareolide itself. In the molecule, the two six-membered rings, A and B, of the labdane skeleton adopt chair conformations and the five-membered O-containing heterocyclic ring C displays an envelope conformation, with the methine C atom of the fused C—C bond as the flap. In the crystal, molecules are linked by O—H⋯O hydrogen bonds, forming chains propagating along [100]. International Union of Crystallography 2015-09-12 /pmc/articles/PMC4647384/ /pubmed/26594436 http://dx.doi.org/10.1107/S2056989015016370 Text en © Shi et al. 2015 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 | Data Reports Shi, Xin-Wei Li, Sheng-Kun Li, Dang-Dang Lu, Qiang-Qiang Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title | Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title_full | Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title_fullStr | Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title_full_unstemmed | Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title_short | Crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
title_sort | crystal structure of 3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan-2-ol |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647384/ https://www.ncbi.nlm.nih.gov/pubmed/26594436 http://dx.doi.org/10.1107/S2056989015016370 |
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