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3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.

The title compound (systematic name: 8β-acet­oxy-14α-benzo­yloxy-N-ethyl-13β,15α-dihydr­oxy-1α,6α,16β-trimeth­oxy-4β-methoxy­methyl­eneaconitane), C(34)H(47)NO(10), is a typical aconitine-type C(19)-diterpenoid alkaloid, and was isolated from the roots of the Aconitum carmichaeli Debx. The mol­ecule...

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Detalles Bibliográficos
Autores principales: Gao, Feng, Zhu, Shou-An, Xiong, Shi-Jun
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979440/
https://www.ncbi.nlm.nih.gov/pubmed/21579431
http://dx.doi.org/10.1107/S1600536810016922
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author Gao, Feng
Zhu, Shou-An
Xiong, Shi-Jun
author_facet Gao, Feng
Zhu, Shou-An
Xiong, Shi-Jun
author_sort Gao, Feng
collection PubMed
description The title compound (systematic name: 8β-acet­oxy-14α-benzo­yloxy-N-ethyl-13β,15α-dihydr­oxy-1α,6α,16β-trimeth­oxy-4β-methoxy­methyl­eneaconitane), C(34)H(47)NO(10), is a typical aconitine-type C(19)-diterpenoid alkaloid, and was isolated from the roots of the Aconitum carmichaeli Debx. The mol­ecule has an aconitine carbon skeleton with four six-membered rings and two five-membered rings, whose geometry is similar to these observed in other C(19)-diterpenoid alkaloids; both of five-membered rings have the envelope configurations and the six-membered N-containing heterocyclic ring displays a chair conformation. Intra­molecular O—H⋯O hydrogen bonding occurs. Weak inter­molecular C—H⋯O hydrogen bonding is observed in the crystal structure.
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spelling pubmed-29794402010-12-30 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx. Gao, Feng Zhu, Shou-An Xiong, Shi-Jun Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound (systematic name: 8β-acet­oxy-14α-benzo­yloxy-N-ethyl-13β,15α-dihydr­oxy-1α,6α,16β-trimeth­oxy-4β-methoxy­methyl­eneaconitane), C(34)H(47)NO(10), is a typical aconitine-type C(19)-diterpenoid alkaloid, and was isolated from the roots of the Aconitum carmichaeli Debx. The mol­ecule has an aconitine carbon skeleton with four six-membered rings and two five-membered rings, whose geometry is similar to these observed in other C(19)-diterpenoid alkaloids; both of five-membered rings have the envelope configurations and the six-membered N-containing heterocyclic ring displays a chair conformation. Intra­molecular O—H⋯O hydrogen bonding occurs. Weak inter­molecular C—H⋯O hydrogen bonding is observed in the crystal structure. International Union of Crystallography 2010-05-15 /pmc/articles/PMC2979440/ /pubmed/21579431 http://dx.doi.org/10.1107/S1600536810016922 Text en © Gao 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
Gao, Feng
Zhu, Shou-An
Xiong, Shi-Jun
3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title_full 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title_fullStr 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title_full_unstemmed 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title_short 3-Deoxy­aconitine from the root of Aconitum Carmichaeli Debx.
title_sort 3-deoxy­aconitine from the root of aconitum carmichaeli debx.
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979440/
https://www.ncbi.nlm.nih.gov/pubmed/21579431
http://dx.doi.org/10.1107/S1600536810016922
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AT zhushouan 3deoxyaconitinefromtherootofaconitumcarmichaelidebx
AT xiongshijun 3deoxyaconitinefromtherootofaconitumcarmichaelidebx