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14-Benzoyl-mesaconine hydro-chloride methanol monosolvate.

ABSTRACT: The title compound, C(31)H(44)N(3)O(10) (+)·Cl(-)·CH(4)O, is the methanol solvate of 8-benzo-yloxy-,9,11,11a-tetra-hydroxy-6,10,13-trimeth-oxy-3-meth-oxy-methyl-1-methyl-tetra-deca-hydro-1H-3,6a,12-(epiethane-1,1,2-tri-yl)-7,9-methanona-phtho[2,3-b]azocin-1-ium chloride, the amine-protonated hydro-chloride of 14-benzoyl-mesaconine hydro-chloride. The cation has an aconitine carbon skeleton with four six-membered rings of which three display chair conformations and one a boat conformation, and two five-membered rings with envelope conformations. In the crystal, the components are connected into an infinite chain by inter- and intra-molecular O-H?O, N-H?O and O-H?Cl hydrogen bonds.

SUBMITTER: Mu Y

PROVIDER: S-EPMC3099831 | biostudies-other | 2011 Apr

REPOSITORIES: biostudies-other

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14-Benzoyl-mesaconine hydro-chloride methanol monosolvate.

Mu Yan Y Li Lin L Wei Hai-Liu HL Kuang Tong-Chun TC Hu Song-Qing SQ

Acta crystallographica. Section E, Structure reports online 20110326 Pt 4

The title compound, C(31)H(44)N(3)O(10) (+)·Cl(-)·CH(4)O, is the methanol solvate of 8-benzo-yloxy-,9,11,11a-tetra-hydroxy-6,10,13-trimeth-oxy-3-meth-oxy-methyl-1-methyl-tetra-deca-hydro-1H-3,6a,12-(epiethane-1,1,2-tri-yl)-7,9-methanona-phtho[2,3-b]azocin-1-ium chloride, the amine-protonated hydro-chloride of 14-benzoyl-mesaconine hydro-chloride. The cation has an aconitine carbon skeleton with four six-membered rings of which three display chair conformations and one a boat conformation, and tw ...[more]

PMID: 21754235

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