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Trichodermin (12,13-ep-oxy-trichethec-9-en-4?-yl 4-fluoro-benzoate).

ABSTRACT: IN THE TITLE TRICHODERMIN COMPOUND (SYSTEMATIC NAME: 12,13-ep-oxy-trichothec-9-en-4?-yl 4-fluoro-benzoate), C(22)H(25)FO(4), the five-membered ring displays an envelope conformation, whereas the two six-membered rings show the different conformations, viz. chair and half-chair. As for the seven-membered ring, the dihedral angle between the mean planes formed by the four C atoms of the envelope unit and the three C and one O atoms of the six-membered chair is 68.67?(2)°; these two mean planes are nearly perpendicular to the ep-oxy ring with angles of 87.97?(2)and 88.14?(2)°, respectively.

SUBMITTER: Xu XH 

PROVIDER: S-EPMC3007378 | biostudies-literature | 2010 Jul

REPOSITORIES: biostudies-literature

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Trichodermin (12,13-ep-oxy-trichethec-9-en-4β-yl 4-fluoro-benzoate).

Xu Xu-Hui XH   Wang Zong-Cheng ZC   Cheng Jing-Li JL   Zhou Yong Y   Zhao Jin-Hao JH  

Acta crystallographica. Section E, Structure reports online 20100724 Pt 8

IN THE TITLE TRICHODERMIN COMPOUND (SYSTEMATIC NAME: 12,13-ep-oxy-trichothec-9-en-4β-yl 4-fluoro-benzoate), C(22)H(25)FO(4), the five-membered ring displays an envelope conformation, whereas the two six-membered rings show the different conformations, viz. chair and half-chair. As for the seven-membered ring, the dihedral angle between the mean planes formed by the four C atoms of the envelope unit and the three C and one O atoms of the six-membered chair is 68.67 (2)°; these two mean planes are  ...[more]

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