Information card for entry 7150796
| Formula |
C25 H28 N2 O6 |
| Calculated formula |
C25 H28 N2 O6 |
| SMILES |
O(c1ccc(c2c(N)c(oc12)C(=O)C)/C(=C/C(=O)NCCc1cc(OC)c(OC)cc1)C)C |
| Title of publication |
Preparation of 2-, 3-, 4- and 7-(2-alkylcarbamoyl-1-alkylvinyl)benzo[b]furans and their BLT1 and/or BLT2 inhibitory activities |
| Authors of publication |
Ando, Kumiko; Kawamura, Yoko; Akai, Yukiko; Kunitomo, Jun-ichi; Yokomizo, Takehiko; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka |
| Journal of publication |
Organic & Biomolecular Chemistry |
| Year of publication |
2008 |
| Journal volume |
6 |
| Journal issue |
2 |
| Pages of publication |
296 - 307 |
| a |
5.07959 ± 0.00013 Å |
| b |
16.8946 ± 0.0004 Å |
| c |
27.9131 ± 0.0007 Å |
| α |
78.308 ± 0.0014° |
| β |
89.999 ± 0.0014° |
| γ |
81.384 ± 0.0014° |
| Cell volume |
2318.12 ± 0.1 Å3 |
| Cell temperature |
296.1 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 significantly intense reflections |
0.0355 |
| Weighted residual factors for all reflections included in the refinement |
0.0986 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.008 |
| Diffraction radiation wavelength |
1.54187 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7150796.html
