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12-Nitro-methyl-14-deoxy-andro-graph-olide.

ABSTRACT: In the mol-ecule of the title compound {systematic name: 3-[2-(6-hydr-oxy-5-hydroxy-methyl-5,8a-dimethyl-2-methyl-ene-per-hydro-1-napth-yl)-1-(nitro-meth-yl)eth-yl]-2(4H)-furan-one}, C(21)H(31)NO(6), the cyclo-hexane rings have chair conformations. Intra-molecular O-H?O hydrogen bonding results in the formation of a six-membered non-planar ring with a twist conformation. In the crystal structure, inter-molecular O-H?O hydrogen bonds link the mol-ecules into infinite chains along the c axis.

SUBMITTER: Quan JC

PROVIDER: S-EPMC2961773 | biostudies-literature | 2008 Jun

REPOSITORIES: biostudies-literature

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12-Nitro-methyl-14-deoxy-andro-graph-olide.

Quan Ji-Cai JC Chen Jing J Xu Hao H Hu Chen-Hui CH Wang Jin-Tang JT

Acta crystallographica. Section E, Structure reports online 20080628 Pt 7

In the mol-ecule of the title compound {systematic name: 3-[2-(6-hydr-oxy-5-hydroxy-methyl-5,8a-dimethyl-2-methyl-ene-per-hydro-1-napth-yl)-1-(nitro-meth-yl)eth-yl]-2(4H)-furan-one}, C(21)H(31)NO(6), the cyclo-hexane rings have chair conformations. Intra-molecular O-H⋯O hydrogen bonding results in the formation of a six-membered non-planar ring with a twist conformation. In the crystal structure, inter-molecular O-H⋯O hydrogen bonds link the mol-ecules into infinite chains along the c axis. ...[more]

PMID: 21202965

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