Ketcher 01191812062D 1 1.00000 0.00000 0 37 38 0 1 0 999 V2000 15.1194 -30.6346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0406 -29.3668 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.4486 -30.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6097 -30.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4486 -29.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0406 -30.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2871 -32.0562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3397 -31.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6917 -32.5747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 -28.2132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4420 -27.7289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6031 -28.2132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4420 -26.7606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6033 -25.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7646 -24.8234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9257 -25.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9257 -26.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7646 -26.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6033 -26.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1194 -29.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1194 -28.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 -29.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4420 -29.6660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6031 -29.1818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4420 -30.6346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 -26.2764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0871 -24.8233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4425 -35.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8891 -35.7088 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 12.9581 -34.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9896 -34.8286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9577 -31.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4423 -33.9897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4422 -32.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 -33.1510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9583 -36.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3038 -34.8206 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 20 1 1 0 0 0 2 20 1 0 0 0 2 4 1 0 0 0 6 4 1 0 0 0 4 3 1 0 0 0 4 5 1 0 0 0 6 8 1 6 0 0 8 7 1 0 0 0 8 9 2 0 0 0 22 10 1 1 0 0 10 11 1 0 0 0 11 13 1 0 0 0 11 12 2 0 0 0 13 19 1 0 0 0 14 15 1 0 0 0 14 19 2 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 20 21 1 6 0 0 20 22 1 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 13 26 1 1 0 0 16 27 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 30 31 1 1 0 0 30 33 1 0 0 0 25 32 1 0 0 0 32 34 1 0 0 0 33 35 1 0 0 0 34 35 1 0 0 0 36 28 2 0 0 0 31 37 1 0 0 0 M END > CHEBI:139489 > amoxicillin-L-lysine residue > The L-α-amino-acid residue derived from amoxicillin-L-lysine. > 3 > N(epsilon)-amoxicilloyl-L-lysine residue; N(6)-amoxicilloyl-L-lysine residue; amoxicillin-lysine residue > C22H31N5O6S > 493.578 > 493.19950 > 0 > N1[C@H](C(S[C@]1([H])[C@H](NC([C@@H](C2=CC=C(C=C2)O)N)=O)C(=O)NCCCC[C@@H](C(*)=O)N*)(C)C)C(O)=O > 29148816 $$$$