null CDK 0224162200 null 30 33 0 0 0 0 0 0 0 0999 V2000 -1.2471 -3.0749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9822 -2.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1113 -1.8855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9261 -1.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3007 -2.4915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7173 -3.0749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3007 -1.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1245 -0.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4991 -0.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0497 0.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2259 0.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8513 -0.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0275 -0.3726 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.5739 -1.6701 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.5279 -1.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7414 -0.5052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -1.5156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1477 -0.9323 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6773 -0.9323 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6773 -0.1073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1477 -0.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 0.4761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 0.1477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9469 -0.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -1.1872 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6656 -0.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6656 -0.1148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7169 0.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1649 1.5454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5239 1.1038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 7 1 0 0 0 0 12 13 1 0 0 0 0 8 14 1 0 0 0 0 3 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 17 1 6 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 18 1 0 0 0 0 21 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 19 25 1 1 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 23 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M END > CHEBI:94407 > (5S,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > 2 > C19H17ClFN3O5S > 453.874 > 453.05615 > 0 > CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)N[C@H]3[C@H]4N(C3=O)C(C(S4)(C)C)C(=O)O > InChI=1S/C19H17ClFN3O5S/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28)/t13-,14?,17+/m1/s1 > UIOFUWFRIANQPC-HFIQTRLSSA-N > LSM-5094 $$$$