Crystal structure of (3S)-3-acetoxy-17-(pyridin-3-yl) androsta-5,16-diene

Shengjun Zhou, Huaqi Huang, Rongbin Huang*, William Thomas Alexander Harrison

*Corresponding author for this work

Research output: Contribution to journalArticle

2 Citations (Scopus)

Abstract

In the title compound, C26H33NO2 [systematic name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,-4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phen-anthren-3-yl acetate], the steroid A, B, C and D rings adopt chair, half-chair, chair and envelope conformations, respectively. The flap atom of the envelope is the methine C atom fused with the C ring. In the crystal, adjacent molecules, generated by a 21 screw axis, are linked by weak C - H⋯O hydrogen bonds, forming a C(16) helical chain running along the c - axis direction.

Original languageEnglish
Pages (from-to)146-147
Number of pages2
JournalActa Crystallographica Section E: Structure Reports Online
Volume71
Issue number3
DOIs
Publication statusPublished - 1 Mar 2015

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dienes
seats
Crystal structure
Atoms
crystal structure
envelopes
Conformations
Hydrogen bonds
steroids
Acetates
rings
Steroids
screws
Crystals
Molecules
atoms
acetates
hydrogen bonds
crystals
molecules

Keywords

  • Androsta-5,16-diene
  • C(16) chain
  • Crystal structure
  • Hydrogen bonds

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Materials Science(all)
  • Chemistry(all)

Cite this

Crystal structure of (3S)-3-acetoxy-17-(pyridin-3-yl) androsta-5,16-diene. / Zhou, Shengjun; Huang, Huaqi; Huang, Rongbin; Harrison, William Thomas Alexander.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 71, No. 3, 01.03.2015, p. 146-147.

Research output: Contribution to journalArticle

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AB - In the title compound, C26H33NO2 [systematic name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,-4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phen-anthren-3-yl acetate], the steroid A, B, C and D rings adopt chair, half-chair, chair and envelope conformations, respectively. The flap atom of the envelope is the methine C atom fused with the C ring. In the crystal, adjacent molecules, generated by a 21 screw axis, are linked by weak C - H⋯O hydrogen bonds, forming a C(16) helical chain running along the c - axis direction.

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