Crystal Structure of 12b-acetoxy-12-(3-fluorobenzoyloxy)-4,6-bis(2,2,2-trichloroethoxycarbonyl)- 1,2a,3,4,4a,6,9,10,11,12,12a,12b-decahydro-9,11-dihydroxy-4a,8,13,13- tetramethyl-7,11-methano-5<i>H</i>-cyclodeca[3,4]benz[1,2-<i>b</i>]oxet-5-one monohydrate ethyl acetate monosolvate
| Id | 2229564 |
| Common name | 12b-acetoxy-12-(3-fluorobenzoyloxy)-4,6-bis(2,2,2-trichloroethoxycarbonyl)- 1,2a,3,4,4a,6,9,10,11,12,12a,12b-decahydro-9,11-dihydroxy-4a,8,13,13- tetramethyl-7,11-methano-5<i>H</i>-cyclodeca[3,4]benz[1,2-<i>b</i>]oxet-5-one monohydrate ethyl acetate monosolvate |
| Chemical name | (1<i>S</i>,2<i>S</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,7<i>S</i>,8<i>S</i>, 10<i>R</i>,13<i>S</i>)-2-Debenzoyl-10-deacetyl-2-(3-fluorobenzoyl)-7,10- bis(2,2,2-trichloroethoxycarbonyl)baccatin III monohydrate ethyl acetate monosolvate |
| a (Å) | 14.7037(11) |
| b (Å) | 16.6601(12) |
| c (Å) | 18.9258(14) |
| α (°) | 90.00 |
| β (°) | 90.00 |
| γ (°) | 90.00 |
| V (Å3) | 4636.2(6) |
| Space group | P 21 21 21 |
| Temperature (K) | 293(2) |
| Rint | 0.0514 |
Publication: Acta Crystallographica Section E (2011) 67, 3 o547