Crystallography Open Database

Information card for entry 1563709

Preview

Coordinates	1563709.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 O10
Calculated formula	C20 H16 O10
SMILES	O1C2=CC(=O)c3c(C2=C2C1(O)CC(=O)c1c(O)cc(O)cc21)cc(O)cc3O.O.O
Title of publication	Naphtho-γ-pyrone Dimers from an Endozoic <i>Aspergillus niger</i> and the Effects of Coisolated Monomers in Combination with Cisplatin on a Cisplatin-Resistant A549 Cell Line.
Authors of publication	Hu, Yun-Wei; Liu, Ying; Guo, Er-Yan; Wang, Yu-Ying; Xu, Wan-Qi; Gao, Yan; Jiang, Xue-Yang; Feng, Feng; Xu, Jian; Liu, Wen-Yuan
Journal of publication	Journal of natural products
Year of publication	2021
a	7.16 ± 0.003 Å
b	9.102 ± 0.004 Å
c	13.073 ± 0.006 Å
α	101.32 ± 0.015°
β	93.023 ± 0.016°
γ	99.194 ± 0.015°
Cell volume	821.5 ± 0.6 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1851
Residual factor for significantly intense reflections	0.1235
Weighted residual factors for significantly intense reflections	0.3286
Weighted residual factors for all reflections included in the refinement	0.3766
Goodness-of-fit parameter for all reflections included in the refinement	0.852
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
266699 (current)	2021-06-26	cif/ Adding structures of 1563709 via cif-deposit CGI script.	1563709.cif