Crystallography Open Database

Information card for entry 7251055

Preview

Coordinates	7251055.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	chromen-6(2H)-one
Chemical name	3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydropyrano[3,2-c]iso chromen-6(2H)-one
Formula	C14 H18 O10
Calculated formula	C14 H18 O10
Title of publication	Isolation and comprehensive characterization of a bioactive compound from Garcinia nervosa: single-crystal X-ray diffraction, antioxidant, protein-binding, and chemosensing studies
Authors of publication	Uzma,; Parveen, Mehtab; Fatima, Sabiha; Kumar, Avadhesh; Azeem, Mohammad; Siddiqui, Masooma; Alam, Mahboob
Journal of publication	RSC Advances
Year of publication	2025
Journal volume	15
Journal issue	46
Pages of publication	38916 - 38932
a	7.4995 ± 0.0005 Å
b	13.933 ± 0.002 Å
c	14.2792 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	1492 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
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	0.0492
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0801
Weighted residual factors for all reflections included in the refinement	0.0881
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
302949 (current)	2025-10-17	cif/ Adding structures of 7251055 via cif-deposit CGI script.	7251055.cif