Marvin 02030917442D 42 46 0 0 0 0 999 V2000 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3974 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3974 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1820 -0.6674 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5724 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1820 0.6674 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6669 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4369 -1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3857 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3857 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8849 -2.0652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2439 -1.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1434 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.6500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -0.9959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3974 1.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5194 -2.8347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5194 -3.6597 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7347 -2.5798 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3444 -2.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3444 -3.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7347 -3.9146 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2498 -3.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4798 -1.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5311 -2.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5311 -3.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0318 -1.1820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6728 -1.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9277 -2.2513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5194 -4.4847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7347 -4.7396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0203 -4.3271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9584 -2.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 0 0 0 0 1 2 2 0 0 0 0 2 21 1 0 0 0 0 3 2 1 0 0 0 0 4 3 2 0 0 0 0 5 6 2 0 0 0 0 5 4 1 0 0 0 0 8 7 1 0 0 0 0 9 7 1 0 0 0 0 10 7 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 13 9 1 0 0 0 0 9 14 1 6 0 0 0 11 10 1 0 0 0 0 11 19 1 1 0 0 0 13 12 1 0 0 0 0 15 13 1 0 0 0 0 16 13 1 0 0 0 0 17 14 2 0 0 0 0 18 14 1 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 20 2 0 0 0 0 21 23 1 1 0 0 0 10 24 2 0 0 0 0 8 25 1 6 0 0 0 27 26 1 0 0 0 0 28 26 1 0 0 0 0 29 26 1 0 0 0 0 27 30 1 0 0 0 0 27 31 1 0 0 0 0 32 28 1 0 0 0 0 28 33 1 6 0 0 0 30 29 1 0 0 0 0 32 31 1 0 0 0 0 34 32 1 0 0 0 0 35 32 1 0 0 0 0 36 33 2 0 0 0 0 37 33 1 0 0 0 0 29 38 2 0 0 0 0 27 39 1 6 0 0 0 31 40 2 0 0 0 0 31 41 2 0 0 0 0 18 42 1 0 0 0 0 37 42 1 0 0 0 0 M END > CHEBI:51770 > sultamicillin > 3 > VD 1827; sultamicillinum; sultamicilina; [(2,2-dimethyl-1,1-dioxidopenam-3alpha-carbonyl)oxy]methyl 6beta-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3alpha-carboxylate > ({6beta-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3alpha-carbonyl}oxy)methyl 2,2-dimethylpenam-3alpha-carboxylate 1,1-dioxide > sultamicillin > C25H30N4O9S2 > 594.65926 > 594.14542 > 0 > [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@@]2([H])S(=O)(=O)C1(C)C > InChI=1S/C25H30N4O9S2/c1-24(2)17(29-20(32)16(21(29)39-24)27-19(31)15(26)12-8-6-5-7-9-12)22(33)37-11-38-23(34)18-25(3,4)40(35,36)14-10-13(30)28(14)18/h5-9,14-18,21H,10-11,26H2,1-4H3,(H,27,31)/t14-,15-,16-,17+,18+,21-/m1/s1 > OPYGFNJSCUDTBT-PMLPCWDUSA-N > 8958037 > 76497-13-7 > 76497-13-7 $$$$