Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate

The asymmetric unit of the title compound, C(54)H(64)O(12)S(4), consists of one half of the mol­ecule, which is located on an inversion centre. The heterocyclic six-membered ring adopts a distorted envelope conformation with the spiro C atom as the flap. In the crystal, mol­ecules are linked by weak...

Descripción completa

Detalles Bibliográficos
Autores principales: Akkurt, Mehmet, Jasinski, Jerry P., Mohamed, Shaaban K., Omran, Omran A., Albayati, Mustafa R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647429/
https://www.ncbi.nlm.nih.gov/pubmed/26594475
http://dx.doi.org/10.1107/S205698901501748X
_version_ 1782401097046949888
author Akkurt, Mehmet
Jasinski, Jerry P.
Mohamed, Shaaban K.
Omran, Omran A.
Albayati, Mustafa R.
author_facet Akkurt, Mehmet
Jasinski, Jerry P.
Mohamed, Shaaban K.
Omran, Omran A.
Albayati, Mustafa R.
author_sort Akkurt, Mehmet
collection PubMed
description The asymmetric unit of the title compound, C(54)H(64)O(12)S(4), consists of one half of the mol­ecule, which is located on an inversion centre. The heterocyclic six-membered ring adopts a distorted envelope conformation with the spiro C atom as the flap. In the crystal, mol­ecules are linked by weak C—H⋯O hydrogen bonds with an R (2) (2)(14) motif, forming a chain along the b-axis direction.
format Online
Article
Text
id pubmed-4647429
institution National Center for Biotechnology Information
language English
publishDate 2015
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-46474292015-11-20 Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate Akkurt, Mehmet Jasinski, Jerry P. Mohamed, Shaaban K. Omran, Omran A. Albayati, Mustafa R. Acta Crystallogr E Crystallogr Commun Data Reports The asymmetric unit of the title compound, C(54)H(64)O(12)S(4), consists of one half of the mol­ecule, which is located on an inversion centre. The heterocyclic six-membered ring adopts a distorted envelope conformation with the spiro C atom as the flap. In the crystal, mol­ecules are linked by weak C—H⋯O hydrogen bonds with an R (2) (2)(14) motif, forming a chain along the b-axis direction. International Union of Crystallography 2015-09-26 /pmc/articles/PMC4647429/ /pubmed/26594475 http://dx.doi.org/10.1107/S205698901501748X Text en © Akkurt 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
Akkurt, Mehmet
Jasinski, Jerry P.
Mohamed, Shaaban K.
Omran, Omran A.
Albayati, Mustafa R.
Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title_full Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title_fullStr Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title_full_unstemmed Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title_short Crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
title_sort crystal structure of tetra­ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but­yl-3,16-dioxa-9,22,28,31-tetra­thia­hepta­cyclo­[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca­ene-2,2,15,15-tetra­carboxyl­ate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4647429/
https://www.ncbi.nlm.nih.gov/pubmed/26594475
http://dx.doi.org/10.1107/S205698901501748X
work_keys_str_mv AT akkurtmehmet crystalstructureoftetraethyl2730dioxo7122025tetratertbutyl316dioxa9222831tetrathiaheptacyclo2131115148110141141811721dotriaconta468291012171921322325decaene221515tetracarboxylate
AT jasinskijerryp crystalstructureoftetraethyl2730dioxo7122025tetratertbutyl316dioxa9222831tetrathiaheptacyclo2131115148110141141811721dotriaconta468291012171921322325decaene221515tetracarboxylate
AT mohamedshaabank crystalstructureoftetraethyl2730dioxo7122025tetratertbutyl316dioxa9222831tetrathiaheptacyclo2131115148110141141811721dotriaconta468291012171921322325decaene221515tetracarboxylate
AT omranomrana crystalstructureoftetraethyl2730dioxo7122025tetratertbutyl316dioxa9222831tetrathiaheptacyclo2131115148110141141811721dotriaconta468291012171921322325decaene221515tetracarboxylate
AT albayatimustafar crystalstructureoftetraethyl2730dioxo7122025tetratertbutyl316dioxa9222831tetrathiaheptacyclo2131115148110141141811721dotriaconta468291012171921322325decaene221515tetracarboxylate

Ejemplares similares