HMDB0030811 RDKit 3D Prudomestin 38 40 0 0 0 0 0 0 0 0999 V2000 6.5022 -0.9078 -0.3464 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2846 -1.6137 -0.2618 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0441 -0.9707 -0.2523 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9226 -1.7667 -0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6542 -1.2514 -0.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 0.1363 -0.2197 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0898 0.6290 -0.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8901 -0.2827 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 0.0611 -0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0534 -0.9730 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6293 -2.2936 0.0684 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -2.9722 1.2728 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3843 -0.6274 0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3473 -1.6463 0.1323 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 0.6875 -0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8562 1.7505 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3217 3.0332 -0.1691 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5206 1.4042 -0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5638 2.3702 -0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8165 3.5821 -0.2924 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2178 1.9514 -0.2596 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7574 2.9298 -0.3508 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5923 0.9056 -0.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8798 0.3711 -0.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7141 -0.5054 -1.3471 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5801 -0.1131 0.4275 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3171 -1.6407 -0.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0243 -2.8426 -0.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8119 -1.9220 -0.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2653 -2.9310 1.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6396 -4.0473 1.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9141 -2.5545 2.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0358 -2.6055 0.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8144 0.9635 0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9541 3.9095 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5265 3.9099 -0.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5447 1.9735 -0.3627 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7547 1.0004 -0.3894 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 1 0 13 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 6 23 1 0 23 24 2 0 24 3 1 0 21 7 2 0 18 9 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 12 30 1 0 12 31 1 0 12 32 1 0 14 33 1 0 15 34 1 0 17 35 1 0 22 36 1 0 23 37 1 0 24 38 1 0 M END