Redetermination and absolute configuration of berkeleydione

Research output: Contribution to journalArticlepeer-review

7 Scopus citations

Abstract

The crystal structure of the title compound, berkeleydione [systematic name; (5aS,7R,9S,11R,11aS)-methyl 9-hydroxy-1,1,5,7,9,11a-hexamethyl-14-methylidene-3,8,10-trioxo-1,3,4,5a,6,7,8,9,10,11,11a,12-dodecahydro-7,11-methanocyclo-octa[4,5]cyclohepta[1,2-c]pyran-11-carboxylate], C26H32O7, has been reported previously [Stierle et al. (2004). Org. Lett. 6,1049-1052]. However, the absolute configuration could not be determined from the data collected with Mo Ka radiation and has now been determined by refinement of the Flack parameter with data collected using Cu Kα radiation. It is in agreement with the previous circular dichroism assignment, and the crystal packing is similar to that described previously.

Original languageEnglish
Pages (from-to)o248
JournalActa Crystallographica Section E: Structure Reports Online
Volume71
Issue number4
DOIs
StatePublished - Apr 1 2015

Funding

Funder number
P20GM103546
1337908

    Keywords

    • Absolute structure
    • Berkeley pit
    • Crystal structure
    • Helicity rule
    • Resonant scattering

    Fingerprint

    Dive into the research topics of 'Redetermination and absolute configuration of berkeleydione'. Together they form a unique fingerprint.

    Cite this