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4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate
The main molecule of the title solvate, C(33)H(30)N(2)O(10)·CH(3)OH, is a new antitumor agent, which shows cytotoxicity against MDR cancer cell lines. It has been synthesized by coupling 4β-aminopodophyllotoxin with (5-methoxy-1H-indol-3-yl)glyoxyl chloride and structurally characterized. There...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959988/ https://www.ncbi.nlm.nih.gov/pubmed/21581314 http://dx.doi.org/10.1107/S1600536808035319 |
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author | Feng, Min Zhao, Ming Zhang, Jingze Yang, Zaixin Chen, Hong |
author_facet | Feng, Min Zhao, Ming Zhang, Jingze Yang, Zaixin Chen, Hong |
author_sort | Feng, Min |
collection | PubMed |
description | The main molecule of the title solvate, C(33)H(30)N(2)O(10)·CH(3)OH, is a new antitumor agent, which shows cytotoxicity against MDR cancer cell lines. It has been synthesized by coupling 4β-aminopodophyllotoxin with (5-methoxy-1H-indol-3-yl)glyoxyl chloride and structurally characterized. There are two crystallographically independent molecules in the asymmetric unit, which differ in the dihedral angles between the aromatic rings. The dihedral angles between the benzene ring of the benzo[d][1,3]dioxole and the benzene ring of the 5-methoxy-1H-indole are 85.08 (3) and 76.88 (3)° and reflect the main conformational difference between the two independent molecules. The asymmetric unit is completed with two methanol solvent molecules, one of which is disordered over two positions, with occupancies close to 0.5. |
format | Text |
id | pubmed-2959988 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29599882010-12-30 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate Feng, Min Zhao, Ming Zhang, Jingze Yang, Zaixin Chen, Hong Acta Crystallogr Sect E Struct Rep Online Organic Papers The main molecule of the title solvate, C(33)H(30)N(2)O(10)·CH(3)OH, is a new antitumor agent, which shows cytotoxicity against MDR cancer cell lines. It has been synthesized by coupling 4β-aminopodophyllotoxin with (5-methoxy-1H-indol-3-yl)glyoxyl chloride and structurally characterized. There are two crystallographically independent molecules in the asymmetric unit, which differ in the dihedral angles between the aromatic rings. The dihedral angles between the benzene ring of the benzo[d][1,3]dioxole and the benzene ring of the 5-methoxy-1H-indole are 85.08 (3) and 76.88 (3)° and reflect the main conformational difference between the two independent molecules. The asymmetric unit is completed with two methanol solvent molecules, one of which is disordered over two positions, with occupancies close to 0.5. International Union of Crystallography 2008-11-13 /pmc/articles/PMC2959988/ /pubmed/21581314 http://dx.doi.org/10.1107/S1600536808035319 Text en © Feng et al. 2008 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 Feng, Min Zhao, Ming Zhang, Jingze Yang, Zaixin Chen, Hong 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title | 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title_full | 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title_fullStr | 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title_full_unstemmed | 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title_short | 4-Desoxy-4β-[(5-methoxy-1H-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
title_sort | 4-desoxy-4β-[(5-methoxy-1h-indol-3-yl)oxalylamino]podophyllotoxin methanol solvate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959988/ https://www.ncbi.nlm.nih.gov/pubmed/21581314 http://dx.doi.org/10.1107/S1600536808035319 |
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