HMDB0260035 RDKit 3D Zoapatanol 58 58 0 0 0 0 0 0 0 0999 V2000 6.0911 1.0554 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8652 1.6092 1.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9746 2.5120 2.6399 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6752 1.3136 0.9868 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.4119 -0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7209 -0.7640 0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3194 -0.8325 1.3647 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3955 -1.8601 -0.7502 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -2.4109 -1.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6205 -1.3509 -1.9163 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.7234 -1.5308 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5873 -1.6836 -0.8271 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9299 -1.1048 -0.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6602 -2.2946 0.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5922 -0.7998 -1.5936 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9107 -0.3929 -1.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8795 1.0156 -0.8668 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9848 1.5776 -0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2909 0.8811 -0.4213 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1505 1.6483 -1.2343 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6401 1.8390 -0.8271 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7651 1.3514 0.2688 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7741 -0.0790 0.5999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6468 -0.2707 1.6919 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9627 -0.0532 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9483 1.2899 1.5139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2410 1.5129 -0.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5899 1.9952 3.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5487 3.4284 2.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9701 2.7883 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 1.7252 1.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 1.0144 -0.9716 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5126 0.1165 -0.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8484 -2.6606 -0.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6535 -3.4837 -1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -2.3227 -0.3688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0699 -1.7829 -2.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -0.6512 -2.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4058 -2.2369 -2.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1412 -0.2870 -2.4418 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 0.1594 -0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7121 -2.6006 -1.4662 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -2.0572 0.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9194 -2.9455 0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1435 -2.9040 -0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3568 -1.9243 1.0253 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4759 -1.0840 -0.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3938 -0.3474 -2.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9496 2.5927 -0.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2699 -0.1633 -0.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7010 1.0196 0.6179 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9927 1.1578 -1.4101 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8871 2.9184 -0.7571 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0865 1.7264 -1.8058 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7194 1.7559 0.1963 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 1.9048 1.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7552 -0.2871 1.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5498 0.0377 1.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 3 18 19 1 0 19 20 1 0 17 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 13 1 0 1 25 1 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 14 44 1 0 14 45 1 0 14 46 1 0 16 47 1 0 16 48 1 0 18 49 1 0 19 50 1 0 19 51 1 0 20 52 1 0 21 53 1 0 21 54 1 0 22 55 1 0 22 56 1 0 23 57 1 0 24 58 1 0 M END