Ketcher 03301621562D 1 1.00000 0.00000 0 31 34 0 1 0 999 V2000 19.4699 -7.0668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.2776 -6.4794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6699 -6.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9705 -5.5325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9696 -5.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2318 -6.7865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2237 -3.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2274 -3.0945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8153 -4.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3930 -4.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3894 -4.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8078 -3.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8191 -4.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7156 -6.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4700 -8.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3302 -8.5681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6023 -8.5682 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4025 -5.0077 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.2403 -3.2836 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 17.7356 -8.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8687 -8.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0050 -8.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1349 -8.5557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1286 -9.5570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2713 -8.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0112 -7.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1475 -6.5525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2774 -7.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9923 -10.0637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8624 -9.5690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8201 -4.1922 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 1 1 0 0 0 15 1 1 0 0 0 4 2 1 0 0 0 6 2 2 0 0 0 5 3 1 0 0 0 3 14 1 1 0 0 5 4 1 0 0 0 5 11 1 1 0 0 12 7 2 0 0 0 8 7 1 0 0 0 9 8 2 0 0 0 10 9 1 0 0 0 13 9 1 0 0 0 11 10 2 0 0 0 12 11 1 0 0 0 16 15 2 0 0 0 17 15 1 0 0 0 13 18 1 0 0 0 13 19 1 0 0 0 17 20 1 0 0 0 20 21 1 0 0 0 23 22 2 0 0 0 21 22 1 0 0 0 26 22 1 0 0 0 24 23 1 0 0 0 25 23 1 0 0 0 30 21 2 0 0 0 29 24 2 0 0 0 28 25 2 0 0 0 27 26 2 0 0 0 28 27 1 0 0 0 30 29 1 0 0 0 13 31 1 0 0 0 M END > CHEBI:131615 > tarocin A2 > A member of the class of oxazolidinones that is oxazolidin-2-one substituted at positions 3, 4 and 5 by 3-(isoquinolin-4-ylmethyl)carbamoyl, methyl and 3-(trifluoromethyl)phenyl groups respectively. An inhibitor of teichoic acid biosynthesis. > 3 > (4S,5R)-N-[(isoquinolin-4-yl)methyl]-4-methyl-2-oxo-5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-3-carboxamide > C22H18F3N3O3 > 429.393 > 429.13003 > 0 > N1(C(O[C@@H]([C@@H]1C)C2=CC(=CC=C2)C(F)(F)F)=O)C(=O)NCC=3C4=C(C=NC3)C=CC=C4 > InChI=1S/C22H18F3N3O3/c1-13-19(14-6-4-7-17(9-14)22(23,24)25)31-21(30)28(13)20(29)27-12-16-11-26-10-15-5-2-3-8-18(15)16/h2-11,13,19H,12H2,1H3,(H,27,29)/t13-,19-/m0/s1 > HDCFKIPEUIIJHB-DJJJIMSYSA-N > 26962156 $$$$