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Information card for entry 7230112
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Coordinates | 7230112.cif |
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Original paper (by DOI) | HTML |
Common name | (3S,16S)-12,16-epoxy-3,11,14-trihydroxy-17(15\ρightarrow16)-abeo-abieta-8(9),11(12),13(14)-triene-7-one |
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Chemical name | szemaoenoid J |
Formula | C20 H26 O5 |
Calculated formula | C20 H26 O5 |
Title of publication | Isolation, identification and bioactivities of abietane diterpenoids from Premna szemaoensis |
Authors of publication | Pu, De-Bing; Wang, Ting; Zhang, Xing-Jie; Gao, Jun-Bo; Zhang, Rui-Han; Li, Xiao-Nian; Wang, Yong-Mei; Li, Xiao-Li; Wang, He-Yao; Xiao, Wei-Lie |
Journal of publication | RSC Advances |
Year of publication | 2018 |
Journal volume | 8 |
Journal issue | 12 |
Pages of publication | 6425 |
a | 11.5843 ± 0.0007 Å |
b | 9.5501 ± 0.0006 Å |
c | 15.2093 ± 0.001 Å |
α | 90° |
β | 92.859 ± 0.004° |
γ | 90° |
Cell volume | 1680.53 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0701 |
Residual factor for significantly intense reflections | 0.0627 |
Weighted residual factors for significantly intense reflections | 0.1682 |
Weighted residual factors for all reflections included in the refinement | 0.1743 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
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/7230112.html
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Users of the data should acknowledge the original authors of the
structural data.