3α,4α-Ep-oxy-5α-androstan-17β-yl acetate

Bibliographic Details
Main Author: Andrade, L. C. R.
Publication Date: 2009
Other Authors: Paixão, J. A., Almeida, M. J. M. de, Roleira, F. M. Fernandes, Tavares da Silva, E. J.
Format: Article
Language: eng
Source: Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)
Download full: https://hdl.handle.net/10316/110234
https://doi.org/10.1107/S160053680900899X
Summary: The title compound, C(21)H(32)O(3), results from modifications of the A and D rings of the aromatase substrate androstenedione. Ring A adopts a conformation between 10β-sofa and 1α,10β half-chair. Rings B and C are in slightly flattened chair conformations. Ring D approaches a 13β-envelope conformation, probably due to the acet-oxy substituent, and shows a very short Csp(3)-Csp(3) bond next to the epoxide ring, which is characteristic of 3-4 epoxides. .
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network_acronym_str RCAP
network_name_str Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)
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spelling 3α,4α-Ep-oxy-5α-androstan-17β-yl acetatesingle-crystal X-ray studyT = 293 K; mean (C–C) = 0.004 A°R factor = 0.044wR factor = 0.135data-to-parameter ratio = 9.7The title compound, C(21)H(32)O(3), results from modifications of the A and D rings of the aromatase substrate androstenedione. Ring A adopts a conformation between 10β-sofa and 1α,10β half-chair. Rings B and C are in slightly flattened chair conformations. Ring D approaches a 13β-envelope conformation, probably due to the acet-oxy substituent, and shows a very short Csp(3)-Csp(3) bond next to the epoxide ring, which is characteristic of 3-4 epoxides. .International Union of Crystallography2009-03-25info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articlehttps://hdl.handle.net/10316/110234https://hdl.handle.net/10316/110234https://doi.org/10.1107/S160053680900899Xeng1600-5368Andrade, L. C. R.Paixão, J. A.Almeida, M. J. M. deRoleira, F. M. FernandesTavares da Silva, E. J.info:eu-repo/semantics/openAccessreponame:Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)instname:FCCN, serviços digitais da FCT – Fundação para a Ciência e a Tecnologiainstacron:RCAAP2023-11-20T14:03:11Zoai:estudogeral.uc.pt:10316/110234Portal AgregadorONGhttps://www.rcaap.pt/oai/openaireinfo@rcaap.ptopendoar:https://opendoar.ac.uk/repository/71602025-05-29T06:01:54.124065Repositórios Científicos de Acesso Aberto de Portugal (RCAAP) - FCCN, serviços digitais da FCT – Fundação para a Ciência e a Tecnologiafalse
dc.title.none.fl_str_mv 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
title 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
spellingShingle 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
Andrade, L. C. R.
single-crystal X-ray study
T = 293 K; mean (C–C) = 0.004 A°
R factor = 0.044
wR factor = 0.135
data-to-parameter ratio = 9.7
title_short 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
title_full 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
title_fullStr 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
title_full_unstemmed 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
title_sort 3α,4α-Ep-oxy-5α-androstan-17β-yl acetate
author Andrade, L. C. R.
author_facet Andrade, L. C. R.
Paixão, J. A.
Almeida, M. J. M. de
Roleira, F. M. Fernandes
Tavares da Silva, E. J.
author_role author
author2 Paixão, J. A.
Almeida, M. J. M. de
Roleira, F. M. Fernandes
Tavares da Silva, E. J.
author2_role author
author
author
author
dc.contributor.author.fl_str_mv Andrade, L. C. R.
Paixão, J. A.
Almeida, M. J. M. de
Roleira, F. M. Fernandes
Tavares da Silva, E. J.
dc.subject.por.fl_str_mv single-crystal X-ray study
T = 293 K; mean (C–C) = 0.004 A°
R factor = 0.044
wR factor = 0.135
data-to-parameter ratio = 9.7
topic single-crystal X-ray study
T = 293 K; mean (C–C) = 0.004 A°
R factor = 0.044
wR factor = 0.135
data-to-parameter ratio = 9.7
description The title compound, C(21)H(32)O(3), results from modifications of the A and D rings of the aromatase substrate androstenedione. Ring A adopts a conformation between 10β-sofa and 1α,10β half-chair. Rings B and C are in slightly flattened chair conformations. Ring D approaches a 13β-envelope conformation, probably due to the acet-oxy substituent, and shows a very short Csp(3)-Csp(3) bond next to the epoxide ring, which is characteristic of 3-4 epoxides. .
publishDate 2009
dc.date.none.fl_str_mv 2009-03-25
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv https://hdl.handle.net/10316/110234
https://hdl.handle.net/10316/110234
https://doi.org/10.1107/S160053680900899X
url https://hdl.handle.net/10316/110234
https://doi.org/10.1107/S160053680900899X
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv 1600-5368
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.publisher.none.fl_str_mv International Union of Crystallography
publisher.none.fl_str_mv International Union of Crystallography
dc.source.none.fl_str_mv reponame:Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)
instname:FCCN, serviços digitais da FCT – Fundação para a Ciência e a Tecnologia
instacron:RCAAP
instname_str FCCN, serviços digitais da FCT – Fundação para a Ciência e a Tecnologia
instacron_str RCAAP
institution RCAAP
reponame_str Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)
collection Repositórios Científicos de Acesso Aberto de Portugal (RCAAP)
repository.name.fl_str_mv Repositórios Científicos de Acesso Aberto de Portugal (RCAAP) - FCCN, serviços digitais da FCT – Fundação para a Ciência e a Tecnologia
repository.mail.fl_str_mv info@rcaap.pt
_version_ 1833602554276085760

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