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Crystal structure of betulinic acid methanol monosolvate

The title compound [systematic name: 3β-hy­droxy­lup-20(29)-en-28-oic acid methanol monosolvate], C(30)H(48)O(3)·CH(3)OH, is a solvent pseudopolymorph of a naturally occurring plant-derived lupane-type penta­cyclic triterpenoid, which was isolated from the traditional Chinese medicinal plant Syzygiu...

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Detalles Bibliográficos
Autores principales: Tang, Wei, Chen, Neng-Hua, Li, Guo-Qiang, Wang, Guo-Cai, Li, Yao-Lan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257419/
https://www.ncbi.nlm.nih.gov/pubmed/25553022
http://dx.doi.org/10.1107/S1600536814023848
Descripción
Sumario:The title compound [systematic name: 3β-hy­droxy­lup-20(29)-en-28-oic acid methanol monosolvate], C(30)H(48)O(3)·CH(3)OH, is a solvent pseudopolymorph of a naturally occurring plant-derived lupane-type penta­cyclic triterpenoid, which was isolated from the traditional Chinese medicinal plant Syzygium jambos (L.) Alston. The dihedral angle between the planes of the carb­oxy­lic acid group and the olefinic group is 12.17 (18)°. The A/B, B/C, C/D and D/E ring junctions are all trans-fused. In the crystal, O—H⋯O hydrogen bonds involving the hy­droxy and carb­oxy­lic acid groups and the methanol solvent mol­ecule give rise to a two-dimensional network structure lying parallel to (001).