HMDB0001509 RDKit 3D 20-Hydroxy-leukotriene B4 57 56 0 0 0 0 0 0 0 0999 V2000 7.9125 1.2002 -0.6233 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6345 2.2332 -1.3061 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6538 3.1115 -1.5801 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2391 2.4062 -1.7499 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 2.9664 -0.6443 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3276 2.0401 0.5443 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 2.6234 1.6105 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9747 3.8794 1.9502 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3769 1.7532 2.8023 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5924 0.6995 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7264 0.3506 1.7699 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9274 -0.6905 1.8067 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0767 -1.0158 0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2491 -2.0477 0.6528 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6063 -2.3258 -0.5478 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8947 -1.1803 -1.2428 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -3.0814 -0.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6791 -2.3346 0.8149 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -1.9651 0.5758 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5845 -2.2685 -0.6745 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9604 -0.9114 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8608 -0.1038 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1729 -0.7902 -0.1211 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9202 -1.0647 -1.4086 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1948 0.1101 -2.1039 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0861 3.0575 -2.5084 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2178 3.0312 -2.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8274 1.4049 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6561 3.9927 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3253 3.0160 -1.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3427 1.9073 0.9712 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9941 1.0434 0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4024 2.7872 1.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6753 3.7044 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9933 1.9458 3.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5607 0.0680 3.7643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6974 0.9352 0.8486 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9069 -1.3054 2.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0995 -0.3818 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2291 -2.6702 1.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0443 -3.0103 -1.2137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6285 -0.6434 -0.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4387 -3.9520 0.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -3.5713 -0.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2444 -2.0629 1.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5053 -1.3984 1.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0559 -2.7933 -1.4516 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5636 -2.8027 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3047 -1.0182 -2.3236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9772 -0.3573 -1.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 0.2333 0.4936 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1228 0.8158 -0.9911 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0552 -1.7404 0.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7549 -0.1121 0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8641 -1.5583 -1.1646 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3283 -1.7336 -2.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2079 -0.0204 -3.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 6 8 34 1 0 9 35 1 0 10 36 1 0 11 37 1 0 12 38 1 0 13 39 1 0 14 40 1 0 15 41 1 6 16 42 1 0 17 43 1 0 17 44 1 0 18 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 22 51 1 0 22 52 1 0 23 53 1 0 23 54 1 0 24 55 1 0 24 56 1 0 25 57 1 0 M END