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Information card for entry 1518893
Preview
| Coordinates | 1518893.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H24 O7 |
|---|---|
| Calculated formula | C20 H24 O7 |
| SMILES | O1C(=O)[C@]2(C[C@@H](O)C[C@@]3(C4=CC(=O)O[C@@H](C4=C[C@@H]1[C@@H]23)[C@@H](C(=O)OC)C)C)C |
| Title of publication | Antiproliferative Constituents of the Roots of Ethiopian Podocarpus falcatus and Structure Revision of 2α-Hydroxynagilactone F and Nagilactone I. |
| Authors of publication | Addo, Ermias Mekuria; Chai, Hee-Byung; Hymete, Ariaya; Yeshak, Mariamawit Yonathan; Slebodnick, Carla; Kingston, David G. I.; Rakotondraibe, L. Harinantenaina |
| Journal of publication | Journal of natural products |
| Year of publication | 2015 |
| Journal volume | 78 |
| Journal issue | 4 |
| Pages of publication | 827 - 835 |
| a | 7.7793 ± 0.0001 Å |
| b | 11.7726 ± 0.0001 Å |
| c | 19.7352 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1807.4 ± 0.04 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0356 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.092 |
| Weighted residual factors for all reflections included in the refinement | 0.0931 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518893.cif |
| 138260 | 2015-06-05 | cif/ Updating files of 1518892, 1518893, 1518894 Original log message: Adding full bibliography for 1518892--1518894.cif. |
1518893.cif |
| 134388 | 2015-03-26 | cif/ Adding structures of 1518893 via cif-deposit CGI script. |
1518893.cif |
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Users of the data should acknowledge the original authors of the
structural data.