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2-[(8-Meth-oxy-carbonyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octa-hydro-phenan-thren-3-yl)amino]-3,5-dinitro-benzoic acid ethyl acetate monosolvate.

ABSTRACT: The title compound, C(25)H(27)N(3)O(8)·C(4)H(8)O(2), has a diterpene skeleton in which the fused cyclo-hexane rings exhibit chair and half-chair conformations. An intra-molecular C-H?O hydrogen bond occurs. In the crystal, N-H?O, O-H?O and C-H?O hydrogen bonds are observed.

SUBMITTER: Tong B

PROVIDER: S-EPMC3435697 | biostudies-literature | 2012 Sep

REPOSITORIES: biostudies-literature

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2-[(8-Meth-oxy-carbonyl-4b,8-dimethyl-4b,5,6,7,8,8a,9,10-octa-hydro-phenan-thren-3-yl)amino]-3,5-dinitro-benzoic acid ethyl acetate monosolvate.

Tong Bihai B Zhang Ye Y

Acta crystallographica. Section E, Structure reports online 20120811 Pt 9

The title compound, C(25)H(27)N(3)O(8)·C(4)H(8)O(2), has a diterpene skeleton in which the fused cyclo-hexane rings exhibit chair and half-chair conformations. An intra-molecular C-H⋯O hydrogen bond occurs. In the crystal, N-H⋯O, O-H⋯O and C-H⋯O hydrogen bonds are observed. ...[more]

PMID: 22969568

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