Crystallography Open Database

Information card for entry 1546099

Preview

Coordinates	1546099.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H36 O11
Calculated formula	C20 H36 O11
Title of publication	Cinnamomols A and B, Immunostimulative Diterpenoids with a New Carbon Skeleton from the Leaves of Cinnamomum cassia.
Authors of publication	Zhou, Lei; Tuo, Yali; Hao, Yi; Guo, Xiaoman; Tang, Wei; Xue, Yongbo; Zeng, Junfen; Zhou, Yu; Xiang, Ming; Zuo, Jianping; Yao, Guangmin; Zhang, Yonghui
Journal of publication	Organic letters
Year of publication	2017
Journal volume	19
Journal issue	11
Pages of publication	3029 - 3032
a	17.1874 ± 0.0008 Å
b	17.1874 ± 0.0008 Å
c	42.085 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	10766.6 ± 0.9 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	3
Space group number	154
Hermann-Mauguin space group symbol	P 32 2 1
Hall space group symbol	P 32 2"
Residual factor for all reflections	0.0633
Residual factor for significantly intense reflections	0.0607
Weighted residual factors for significantly intense reflections	0.1674
Weighted residual factors for all reflections included in the refinement	0.1709
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
197507 (current)	2017-06-05	cif/ Updating files of 1546098, 1546099 Original log message: Adding full bibliography for 1546098--1546099.cif.	1546099.cif
196912	2017-05-24	cif/ Adding structures of 1546099 via cif-deposit CGI script.	1546099.cif