HMDB0033254 RDKit 3D Comosin 45 47 0 0 0 0 0 0 0 0999 V2000 6.1698 -1.2573 -1.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6345 -1.2094 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3028 -0.8770 -0.1829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.6001 -1.2591 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1762 -0.2632 -1.1082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6141 -0.2058 0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2097 0.1426 0.3569 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0913 1.6447 0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2484 2.0715 0.2462 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6235 3.3885 0.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0047 3.9041 0.2169 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7285 4.1963 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.0523 1.8166 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5316 0.0514 2.0364 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4832 -0.4994 1.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7686 -0.7676 1.6118 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6882 -1.3202 0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 -1.5917 1.1708 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -1.6117 -0.5439 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0347 -1.3574 -0.9824 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6292 -1.6404 -2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1424 -0.8027 -0.0868 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7621 -0.5176 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4608 -0.8651 -1.6846 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4235 -0.4894 1.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 -0.8236 1.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5424 -1.1037 2.1781 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1439 -0.2692 -2.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2523 -1.5250 -1.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6671 -2.0441 -2.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9804 -0.6496 -2.2443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6574 -0.0606 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8137 2.1826 0.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3536 1.7517 -1.0098 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 3.1322 -0.1182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1434 4.7705 -0.4715 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2159 4.2149 1.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3645 0.7048 2.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1516 -1.0485 2.2042 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0344 -0.5289 2.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1574 -2.5303 1.5709 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -2.0481 -1.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2228 -2.0383 -2.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0663 -0.4653 2.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2408 -1.0926 3.1343 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 1 0 10 11 1 0 10 12 2 0 7 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 23 24 2 0 6 25 1 0 25 26 2 0 26 27 1 0 26 3 1 0 23 7 1 0 22 15 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 5 32 1 0 8 33 1 0 8 34 1 0 11 35 1 0 11 36 1 0 11 37 1 0 13 38 1 0 13 39 1 0 16 40 1 0 18 41 1 0 19 42 1 0 21 43 1 0 25 44 1 0 27 45 1 0 M END