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Kallolide A acetate pyrazoline
In the crystal structure of kallolide A acetate pyrazoline [systematic name: 7-methyl-16-oxo-4,10-bis(prop-1-en-2-yl)-17,18-dioxa-14,15-diazatetracyclo[9.4.2.1(6,9).0(1,12)]octadeca-6,8,14-trien-5-yl acetate], C(23)H(28)N(2)O(5), there is a 12-membered carbon macrocyclic structure. In addition...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254402/ https://www.ncbi.nlm.nih.gov/pubmed/22259545 http://dx.doi.org/10.1107/S1600536811051890 |
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author | Rodríguez-Escudero, Idaliz Marrero, Jeffrey Rodríguez, Abimael D. |
author_facet | Rodríguez-Escudero, Idaliz Marrero, Jeffrey Rodríguez, Abimael D. |
author_sort | Rodríguez-Escudero, Idaliz |
collection | PubMed |
description | In the crystal structure of kallolide A acetate pyrazoline [systematic name: 7-methyl-16-oxo-4,10-bis(prop-1-en-2-yl)-17,18-dioxa-14,15-diazatetracyclo[9.4.2.1(6,9).0(1,12)]octadeca-6,8,14-trien-5-yl acetate], C(23)H(28)N(2)O(5), there is a 12-membered carbon macrocyclic structure. In addition, there is a trisubstituted furan ring, an approximately planar γ-lactone ring [maximum deviation of 0.057 (3) Å] and a pyrazoline ring, the latter in an envelope conformation. The pyrazoline and the γ-lactone rings are fused in a cis configuration. In the crystal, molecules are linked by weak C—H⋯O interactions, forming a two-dimensional network parallel to (001). An intramolecular C—H⋯O hydrogen bond is also present. |
format | Online Article Text |
id | pubmed-3254402 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32544022012-01-18 Kallolide A acetate pyrazoline Rodríguez-Escudero, Idaliz Marrero, Jeffrey Rodríguez, Abimael D. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of kallolide A acetate pyrazoline [systematic name: 7-methyl-16-oxo-4,10-bis(prop-1-en-2-yl)-17,18-dioxa-14,15-diazatetracyclo[9.4.2.1(6,9).0(1,12)]octadeca-6,8,14-trien-5-yl acetate], C(23)H(28)N(2)O(5), there is a 12-membered carbon macrocyclic structure. In addition, there is a trisubstituted furan ring, an approximately planar γ-lactone ring [maximum deviation of 0.057 (3) Å] and a pyrazoline ring, the latter in an envelope conformation. The pyrazoline and the γ-lactone rings are fused in a cis configuration. In the crystal, molecules are linked by weak C—H⋯O interactions, forming a two-dimensional network parallel to (001). An intramolecular C—H⋯O hydrogen bond is also present. International Union of Crystallography 2011-12-07 /pmc/articles/PMC3254402/ /pubmed/22259545 http://dx.doi.org/10.1107/S1600536811051890 Text en © Rodríguez-Escudero et al. 2012 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 Rodríguez-Escudero, Idaliz Marrero, Jeffrey Rodríguez, Abimael D. Kallolide A acetate pyrazoline |
title | Kallolide A acetate pyrazoline |
title_full | Kallolide A acetate pyrazoline |
title_fullStr | Kallolide A acetate pyrazoline |
title_full_unstemmed | Kallolide A acetate pyrazoline |
title_short | Kallolide A acetate pyrazoline |
title_sort | kallolide a acetate pyrazoline |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254402/ https://www.ncbi.nlm.nih.gov/pubmed/22259545 http://dx.doi.org/10.1107/S1600536811051890 |
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