Information card for entry 7229502

Structure parameters

• Formula: C16 H28 O5
• Calculated formula: C16 H28 O5
• SMILES: O1[C@H]([C@H]2O[C@@]31[C@@H](CC2)[C@@H](O)CC[C@H]3O)CCCC[C@@H](O)C
• Title of publication: Antimicrobial polyketides from Trichoderma koningiopsis QA-3, an endophytic fungus obtained from the medicinal plant Artemisia argyi
• Authors of publication: Shi, Xiao-Shan; Wang, Dun-Jia; Li, Xiao-Ming; Li, Hong-Lei; Meng, Ling-Hong; Li, Xin; Pi, Yan; Zhou, Xing-Wang; Wang, Bin-Gui
• Journal of publication: RSC Advances
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 81
• Pages of publication: 51335
• a: 5.4895 ± 0.0004 Å
• b: 13.2356 ± 0.0012 Å
• c: 11.0897 ± 0.001 Å
• α: 90°
• β: 91.805 ± 0.002°
• γ: 90°
• Cell volume: 805.34 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.052
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.1175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No