Information card for entry 1547852

Structure parameters

• Common name: (+)-19-Hydroxyeburnamine
• Formula: C19 H24 N2 O2
• Calculated formula: C19 H24 N2 O2
• SMILES: c12c3CCN4CCC[C@](C[C@@H](n2c2c3cccc2)O)([C@H](C)O)[C@@H]14
• Title of publication: Biosynthetic Enantiodivergence in the Eburnane Alkaloids from Kopsia.
• Authors of publication: Chong, Kam-Weng; Yeap, Joanne Soon-Yee; Lim, Siew-Huah; Weber, Jean-Frédéric F; Low, Yun-Yee; Kam, Toh-Seok
• Journal of publication: Journal of natural products
• Year of publication: 2017
• Journal volume: 80
• Journal issue: 11
• Pages of publication: 3014 - 3024
• a: 8.79926 ± 0.00016 Å
• b: 12.3307 ± 0.0003 Å
• c: 14.2867 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1550.12 ± 0.06 ų
• Cell temperature: 143.1 ± 0.4 K
• Ambient diffraction temperature: 143.1 ± 0.4 K
• Number of distinct elements: 4
• 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: 0.0279
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0712
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No