Information card for entry 7220781

Structure parameters

• Chemical name: gliomasolide A
• Formula: C18 H32 O4
• Calculated formula: C18 H32 O4
• SMILES: O1C(=O)/C=C/[C@@H](O)CC[C@H](O)CCCCC[C@H]1CCCCC
• Title of publication: Gliomasolides A-E, Unusual Macrolides from a Sponge-Derived Fungus Gliomastix sp. ZSDS1-F7-2
• Authors of publication: Zhang, Jun; Lin, Xiuping; Li, Liangchun; Zhong, Baliang; liao, xiaojian; Liu, Yonghong; xu, shihai
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 5.42511 ± 0.00018 Å
• b: 7.6161 ± 0.0002 Å
• c: 21.7672 ± 0.0008 Å
• α: 90°
• β: 91.546 ± 0.003°
• γ: 90°
• Cell volume: 899.05 ± 0.05 ų
• Cell temperature: 99.9 ± 0.4 K
• Ambient diffraction temperature: 99.9 ± 0.4 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: 0.0457
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No