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Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate

In the title compound, C(21)H(28)N(2)O(5) (systematic name: methyl 1,4a-dimethyl-7-nitro-9-oxo-6-propyl­amino-1,2,3,4,4a,9,10,10a-octa­hydro­phenanthrene-1-carboxyl­ate) the cyclo­hexane ring (A) and the central cyclo­hexene ring (B) exist at a trans ring junction, with the two methyl groups in the...

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Detalles Bibliográficos
Autores principales: Wang, Kai, Zhang, Ye, Yi, Xiang-Hui, Zhang, Yong, Pan, Ying-Ming
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983386/
https://www.ncbi.nlm.nih.gov/pubmed/21587581
http://dx.doi.org/10.1107/S1600536810032824
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author Wang, Kai
Zhang, Ye
Yi, Xiang-Hui
Zhang, Yong
Pan, Ying-Ming
author_facet Wang, Kai
Zhang, Ye
Yi, Xiang-Hui
Zhang, Yong
Pan, Ying-Ming
author_sort Wang, Kai
collection PubMed
description In the title compound, C(21)H(28)N(2)O(5) (systematic name: methyl 1,4a-dimethyl-7-nitro-9-oxo-6-propyl­amino-1,2,3,4,4a,9,10,10a-octa­hydro­phenanthrene-1-carboxyl­ate) the cyclo­hexane ring (A) and the central cyclo­hexene ring (B) exist at a trans ring junction, with the two methyl groups in the axial positions of the six-membered rings. Ring A has a chair conformation and ring B a half-chair conformation. An intra­molecular N—H⋯O hydrogen bond occurs. The crystal structure is stabilized by inter­molecular C—H⋯O and N—H⋯O inter­actions.
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spelling pubmed-29833862010-12-30 Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate Wang, Kai Zhang, Ye Yi, Xiang-Hui Zhang, Yong Pan, Ying-Ming Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(21)H(28)N(2)O(5) (systematic name: methyl 1,4a-dimethyl-7-nitro-9-oxo-6-propyl­amino-1,2,3,4,4a,9,10,10a-octa­hydro­phenanthrene-1-carboxyl­ate) the cyclo­hexane ring (A) and the central cyclo­hexene ring (B) exist at a trans ring junction, with the two methyl groups in the axial positions of the six-membered rings. Ring A has a chair conformation and ring B a half-chair conformation. An intra­molecular N—H⋯O hydrogen bond occurs. The crystal structure is stabilized by inter­molecular C—H⋯O and N—H⋯O inter­actions. International Union of Crystallography 2010-09-25 /pmc/articles/PMC2983386/ /pubmed/21587581 http://dx.doi.org/10.1107/S1600536810032824 Text en © Wang et al. 2010 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
Wang, Kai
Zhang, Ye
Yi, Xiang-Hui
Zhang, Yong
Pan, Ying-Ming
Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title_full Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title_fullStr Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title_full_unstemmed Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title_short Methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
title_sort methyl 7-oxo-12-propyl­amino-13-nitro­deisopropyl­dehydro­abietate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983386/
https://www.ncbi.nlm.nih.gov/pubmed/21587581
http://dx.doi.org/10.1107/S1600536810032824
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