Information card for entry 7151285

Structure parameters

• Common name: Clausine C (Clauszoline L)
• Chemical name: methyl 7-methoxy-9H-carbazole-3-carboxylate
• Formula: C15 H13 N O3
• Calculated formula: C15 H13 N O3
• SMILES: c1cc(cc2c3ccc(cc3[nH]c12)OC)C(=O)OC
• Title of publication: First total synthesis of the 7-oxygenated carbazole alkaloids clauszoline-K, 3-formyl-7-hydroxycarbazole, clausine M, clausine N and the anti-HIV active siamenol using a highly efficient palladium-catalyzed approach.
• Authors of publication: Krahl, Micha P.; Jäger, Anne; Krause, Tilo; Knölker, Hans-Joachim
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2006
• Journal volume: 4
• Journal issue: 17
• Pages of publication: 3215 - 3219
• a: 8.118 ± 0.003 Å
• b: 9.02 ± 0.002 Å
• c: 9.143 ± 0.003 Å
• α: 101.1 ± 0.02°
• β: 102.27 ± 0.03°
• γ: 104.33 ± 0.03°
• Cell volume: 612.2 ± 0.4 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0612
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No