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Information card for entry 1518894
Preview
| Coordinates | 1518894.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H22 O7 |
|---|---|
| Calculated formula | C18 H22 O7 |
| SMILES | O1C(=O)[C@]2([C@@H](O)[C@H]3O[C@H]3[C@@]3(c4cc(=O)oc(c4C[C@@H]1[C@@H]23)CC)C)C.O |
| 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 | 7.1335 ± 0.0001 Å |
| b | 8.3601 ± 0.0001 Å |
| c | 26.2049 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1562.78 ± 0.04 Å3 |
| Cell temperature | 99.9 ± 0.14 K |
| Ambient diffraction temperature | 99.9 ± 0.14 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 | 0.034 |
| Residual factor for significantly intense reflections | 0.0323 |
| Weighted residual factors for significantly intense reflections | 0.0818 |
| Weighted residual factors for all reflections included in the refinement | 0.0834 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| 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. |
1518894.cif |
| 138260 | 2015-06-05 | cif/ Updating files of 1518892, 1518893, 1518894 Original log message: Adding full bibliography for 1518892--1518894.cif. |
1518894.cif |
| 134389 | 2015-03-26 | cif/ Adding structures of 1518894 via cif-deposit CGI script. |
1518894.cif |
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Users of the data should acknowledge the original authors of the
structural data.