HMDB0035302 RDKit 3D Ganolucidic acid A 80 83 0 0 0 0 0 0 0 0999 V2000 6.8123 0.7025 2.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1297 -0.2372 1.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8902 -0.8444 0.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 0.1963 -0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2419 1.3584 -0.0028 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6682 -0.2511 -0.7019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9357 0.9497 -1.1432 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8322 1.6721 -2.1478 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5778 0.8800 -1.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2475 0.0719 -2.8468 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2551 -0.2329 -2.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -1.5756 -2.5362 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6912 0.6796 -1.6788 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7599 2.0711 -2.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9412 0.3435 -1.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1804 0.6166 0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 0.9245 1.0833 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0992 0.8483 2.3165 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2875 1.3442 0.4728 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4818 0.4806 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5151 -0.9566 -0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5443 0.6094 0.8019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0882 2.0263 0.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7094 0.5305 2.2714 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5209 -0.8642 2.7691 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7011 -1.6138 2.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -2.5182 2.9076 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2979 -1.2538 0.9667 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5058 -2.6111 0.2549 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7143 -0.7208 1.0766 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4586 -0.3666 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6545 -1.2933 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -0.3305 -1.8058 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0656 -1.2561 1.5772 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 -2.4640 1.5588 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2902 -0.8754 2.0783 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7154 0.7529 2.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5922 1.7264 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9945 0.2298 2.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6929 0.3612 0.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1623 -1.5411 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3662 -1.3829 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1659 -0.7983 0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9507 -0.9826 -1.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9181 1.6420 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6826 1.0349 -2.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1343 2.6527 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2262 1.8541 -3.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2926 1.9443 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7477 -0.8749 -2.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4007 0.6549 -3.7874 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7733 0.0730 -3.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1548 -2.1796 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4728 2.8638 -1.5462 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2695 2.1912 -3.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8542 2.2592 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3304 2.4233 0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1225 1.1238 1.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1757 -1.6010 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5259 -1.3924 -0.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.9983 0.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6041 2.4111 -0.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8216 2.7330 1.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1756 1.9758 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8167 0.7540 2.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2503 1.3298 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3982 -0.9465 3.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6411 -1.4013 2.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1417 -3.1976 0.9837 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5763 -3.1728 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1139 -2.5048 -0.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1992 -1.2606 1.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7799 0.3733 1.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2688 -0.9917 0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1474 0.1636 -0.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8714 -1.8316 -0.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3272 -1.9107 -1.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8026 0.3751 -2.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6482 -0.8116 -2.7128 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8407 -0.1629 1.6204 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 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 16 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 2 34 1 0 34 35 2 0 34 36 1 0 20 9 1 0 31 22 1 0 20 13 1 0 33 15 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 0 3 41 1 0 3 42 1 0 6 43 1 0 6 44 1 0 7 45 1 0 8 46 1 0 8 47 1 0 8 48 1 0 9 49 1 0 10 50 1 0 10 51 1 0 11 52 1 0 12 53 1 0 14 54 1 0 14 55 1 0 14 56 1 0 19 57 1 0 19 58 1 0 21 59 1 0 21 60 1 0 21 61 1 0 23 62 1 0 23 63 1 0 23 64 1 0 24 65 1 0 24 66 1 0 25 67 1 0 25 68 1 0 29 69 1 0 29 70 1 0 29 71 1 0 30 72 1 0 30 73 1 0 30 74 1 0 31 75 1 0 32 76 1 0 32 77 1 0 33 78 1 0 33 79 1 0 36 80 1 0 M END