Crystallography Open Database

Information card for entry 1519612

1519611 << 1519612 >> 1519613

Preview

Coordinates	1519612.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Schizine A
Formula	C24 H25 N O5
Calculated formula	C24 H25 N O5
SMILES	C12=N[C@H](C(=O)O[C@H]1CC([C@@H]1CC=C3[C@H]4[C@@]21C(=O)O[C@H]4OC3)(C)C)Cc1ccccc1
Title of publication	Iminolactones from Schizophyllum commune.
Authors of publication	Liu, Xuemei; Frydenvang, Karla; Liu, Huizhen; Zhai, Lin; Chen, Ming; Olsen, Carl Erik; Christensen, Søren Brøgger
Journal of publication	Journal of natural products
Year of publication	2015
Journal volume	78
Journal issue	5
Pages of publication	1165 - 1168
a	8.713 ± 0.0006 Å
b	11.51 ± 0.0008 Å
c	20.253 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	2031.1 ± 0.2 Å³
Cell temperature	122 ± 1 K
Ambient diffraction temperature	122 ± 1 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	0.0431
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.078
Weighted residual factors for all reflections included in the refinement	0.0827
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
138266 (current)	2015-06-05	cif/ Updating files of 1519612 Original log message: Adding full bibliography for 1519612.cif.	1519612.cif
136301	2015-05-13	cif/ Adding structures of 1519612 via cif-deposit CGI script.	1519612.cif