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Information card for entry 4125296
Preview
Coordinates | 4125296.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H38 O4 |
---|---|
Calculated formula | C32 H38 O4 |
SMILES | O1C2=C(C(=O)[C@]3(C(=O)[C@@]2(C[C@@H](C3(C)C)CC=C)C[C@H](C1(C)C)CC=C)CC=C)C(=O)c1ccccc1.O1C2=C(C(=O)[C@@]3(C(=O)[C@]2(C[C@H](C3(C)C)CC=C)C[C@@H](C1(C)C)CC=C)CC=C)C(=O)c1ccccc1 |
Title of publication | Syntheses of (+)-30-epi-, (-)-6-epi-, (±)-6,30-epi-13,14-Didehydroxyisogarcinol and (±)-6,30-epi-Garcimultiflorone A Utilizing Highly Diastereoselective, Lewis Acid-Controlled Cyclizations. |
Authors of publication | Boyce, Jonathan H.; Eschenbrenner-Lux, Vincent; Porco, Jr, John A |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 44 |
Pages of publication | 14789 - 14797 |
a | 23.1187 ± 0.0004 Å |
b | 7.8379 ± 0.0002 Å |
c | 15.2175 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2757.44 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.0299 |
Residual factor for significantly intense reflections | 0.0294 |
Weighted residual factors for significantly intense reflections | 0.0769 |
Weighted residual factors for all reflections included in the refinement | 0.0772 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4125296.html
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Users of the data should acknowledge the original authors of the
structural data.