HMDB0243546 RDKit 3D (+)-Scopolamine 43 46 0 0 0 0 0 0 0 0999 V2000 -5.3852 0.8747 -0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9805 0.6412 -0.4315 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2111 1.5388 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7393 1.4369 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2255 0.0197 0.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1221 -0.0601 -0.7207 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1588 -0.3689 -0.3211 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3559 -0.5907 0.8987 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3086 -0.4519 -1.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4642 0.8154 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6715 1.8843 -1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5448 -0.8021 -0.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.0074 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2157 -0.3175 1.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9068 -1.4742 0.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3987 -2.2818 -0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -1.9598 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -0.9865 -0.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -0.6531 0.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -0.4437 1.6499 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7887 0.1102 2.4103 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 1.0629 1.7954 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7271 1.8735 -0.4236 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5113 0.6974 0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 0.0548 -0.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5313 2.5694 0.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4854 1.9584 -0.7814 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2193 1.9982 0.9703 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -0.2119 1.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0995 -1.2940 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3409 0.6746 -2.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5795 0.9327 -2.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3698 2.7107 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5245 0.9197 0.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6058 0.3341 1.9538 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8203 -1.7328 1.4126 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9173 -3.1899 -0.3728 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8511 -2.6073 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9217 -1.9935 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2569 -0.9842 -1.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3178 -1.4400 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6448 -0.8892 2.2133 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3306 1.6183 2.3968 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 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 9 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 5 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 19 2 1 0 22 20 1 0 22 3 1 0 17 12 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 9 30 1 0 10 31 1 0 10 32 1 0 11 33 1 0 13 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 18 39 1 0 18 40 1 0 19 41 1 0 20 42 1 0 22 43 1 0 M END