18633075 -OEChem-03282415062D 31 32 0 1 0 0 0 0 0999 V2000 6.0690 1.2664 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -0.7553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4375 1.4133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7088 -2.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3561 -1.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1179 -0.0426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1179 0.9574 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1096 0.9615 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0690 -0.3516 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6567 0.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1096 -0.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 1.6701 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4658 1.0452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4658 -0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3780 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6648 2.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9866 1.7972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5366 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6305 -0.7900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2423 1.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8302 0.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9673 1.4096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 1.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 -0.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9673 -0.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8302 0.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2633 2.4738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8265 3.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0662 2.7972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9004 -2.6355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 11 2 0 0 0 0 3 12 1 0 0 0 0 3 30 1 0 0 0 0 4 15 1 0 0 0 0 4 31 1 0 0 0 0 5 15 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 6 0 0 0 8 11 1 0 0 0 0 8 12 1 1 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 6 0 0 0 9 19 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 12 16 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 M END > 18633075 > 1 > 357 > 5 > 2 > 2 > AAADccByOABAAAAAAAAAAAAAAABYAWAAAAAAAAAABYAAAAAAAAAAHgQACAAADTzlwAaCCAMAAggIAAGQGAAAAABAABAAAAGIAAACEBwggCAEQAAGJgCwAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (2S,5R,6R)-6-(1-hydroxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > (2S,5R,6R)-6-(1-hydroxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > (2S,5R,6R)-6-(1-hydroxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > (2S,5R,6R)-6-(1-hydroxyethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > (2S,5R,6R)-6-(1-hydroxyethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > (2S,5R,6R)-6-(1-hydroxyethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid > InChI=1S/C10H15NO4S/c1-4(12)5-7(13)11-6(9(14)15)10(2,3)16-8(5)11/h4-6,8,12H,1-3H3,(H,14,15)/t4?,5-,6+,8-/m1/s1 > MPTLCUDUQPXSPL-YTQDJDRZSA-N > 1.3 > 245.07217913 > C10H15NO4S > 245.30 > CC(C1C2N(C1=O)C(C(S2)(C)C)C(=O)O)O > CC([C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O)O > 103 > 245.07217913 > 0 > 16 > 3 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 3 3 7 17 6 8 12 5 9 15 6 $$$$