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An orthorhombic polymorph of mulinic acid
The title compound [systematic name: (3S,3aS,10bR)-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,10,10a,10b-decahydro-endo-epidioxycyclohepta[e]indene-3a(1H)-carboxylic acid], C(20)H(30)O(4), is a polymorphic form of a previously reported structure [Loyola et al. (1990 ▶). Tetrahedron, 46, 5413–5420...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979944/ https://www.ncbi.nlm.nih.gov/pubmed/21579761 http://dx.doi.org/10.1107/S1600536810000528 |
Sumario: | The title compound [systematic name: (3S,3aS,10bR)-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,10,10a,10b-decahydro-endo-epidioxycyclohepta[e]indene-3a(1H)-carboxylic acid], C(20)H(30)O(4), is a polymorphic form of a previously reported structure [Loyola et al. (1990 ▶). Tetrahedron, 46, 5413–5420]. The newly found orthorhombic polymorph crystallizes in P2(1)2(1)2(1) with two molecules in the asymmetric unit. The molecules are linked into discrete D(2) chains by simple O—H⋯O interactions. There are only slight variations in the molecular geometry and supramolecular organization in the crystal structures of the two polymorphs. The densities are 1.145 (monoclinic, P2(1)) and 1.155 Mg m(−3) (orthorhombic, P2(1)2(1)2(1)). |
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