Information card for entry 1512158

Structure parameters

• Formula: C27 H35 N O2
• Calculated formula: C27 H35 N O2
• SMILES: O1[C@H]2CC[C@@]3([C@]4(c5[nH]c6ccccc6c5C[C@@H]4CC[C@H]3C2=CC[C@H]1C(O)(C)C)C)C
• Title of publication: Indole-Diterpenoids with Anti-H1N1 Activity from the Aciduric Fungus Penicillium camemberti OUCMDZ-1492.
• Authors of publication: Fan, Yaqin; Wang, Yi; Liu, Peipei; Fu, Peng; Zhu, Tonghan; Wang, Wei; Zhu, Weiming
• Journal of publication: Journal of natural products
• Year of publication: 2013
• Journal volume: 76
• Journal issue: 7
• Pages of publication: 1328 - 1336
• a: 11.542 ± 0.0005 Å
• b: 24.4903 ± 0.0012 Å
• c: 7.7765 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2198.16 ± 0.18 ų
• 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: 0.0317
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0835
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No