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Information card for entry 4034297
Preview
Coordinates | 4034297.cif |
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Original paper (by DOI) | HTML |
Common name | zyh_wzd3651 |
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Formula | C24 H35 N O4 |
Calculated formula | C24 H35 N O4 |
SMILES | N1[C@@H](CC(C)C)[C@H]2[C@@]3(OC(=O)C=C[C@H](O)CCCC(=C[C@H]3C=C([C@H]2C)C)C)C1=O |
Title of publication | Amiaspochalasins A-H, Undescribed Aspochalasins with a C-21 Ester Carbonyl from Aspergillus micronesiensis. |
Authors of publication | Wu, Zhaodi; Zhang, Xiaotian; Al Anbari, Weaam Hasan; Zhang, Mi; Chen, Xia; Luo, Zengwei; Li, Xiao-Nian; Chen, Chunmei; Liu, Junjun; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2019 |
Journal volume | 84 |
Journal issue | 9 |
Pages of publication | 5483 - 5491 |
a | 19.6655 ± 0.0019 Å |
b | 38.468 ± 0.004 Å |
c | 12.8796 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9743.3 ± 1.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 18 |
Hermann-Mauguin space group symbol | P 21 21 2 |
Hall space group symbol | P 2 2ab |
Residual factor for all reflections | 0.0742 |
Residual factor for significantly intense reflections | 0.0619 |
Weighted residual factors for significantly intense reflections | 0.1828 |
Weighted residual factors for all reflections included in the refinement | 0.1987 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.967 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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Users of the data should acknowledge the original authors of the
structural data.