HMDB0256886 RDKit 3D (5R,6R)-3-(2-Acetamidoethylsulfanyl)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-... 38 39 0 0 0 0 0 0 0 0999 V2000 3.9483 2.2220 0.7475 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9594 1.0503 0.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3296 0.0590 -0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2497 0.6627 -1.5493 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9363 1.4079 -2.3031 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9821 0.0527 -1.7574 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6635 -0.3724 -2.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1096 -0.1291 -3.4624 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7573 0.4800 -4.3441 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1659 -0.5691 -3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0655 -1.0041 -1.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5818 -1.6782 -1.2823 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0928 -2.4667 0.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2615 -1.4302 1.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2699 -0.4672 0.9327 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6556 0.6263 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6827 1.5631 1.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1144 0.7935 2.8511 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0046 -1.0098 -0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3381 -0.9017 -0.6954 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 2.6132 1.7834 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5523 3.0443 0.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 1.8574 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 0.6054 1.8759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9705 1.5056 0.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3057 -0.4091 0.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9637 -0.1341 -3.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0821 -2.9607 0.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3984 -3.2775 0.5523 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5181 -1.9080 2.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3156 -0.8652 1.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7245 -0.5960 0.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2031 2.4019 0.6929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4727 1.0926 0.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2065 2.0515 2.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7759 -0.1295 0.6201 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8839 -1.9207 0.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -1.8600 -1.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 7 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 2 0 11 19 1 0 19 20 1 0 20 3 1 0 20 6 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 10 27 1 0 13 28 1 0 13 29 1 0 14 30 1 0 14 31 1 0 15 32 1 0 17 33 1 0 17 34 1 0 17 35 1 0 19 36 1 0 19 37 1 0 20 38 1 0 M END