HMDB0012643 RDKit 3D 20-Trihydroxy-leukotriene-B4 59 58 0 0 0 0 0 0 0 0999 V2000 10.2511 1.0490 0.8384 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0474 0.8091 1.1254 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7487 -0.2213 1.9686 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0227 1.6624 0.5294 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6211 1.3386 0.8738 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1448 -0.0177 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1969 -0.3266 -0.9663 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7246 -1.6210 -1.1534 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4965 0.5932 -1.8484 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2007 0.5422 -1.9934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2843 -0.3748 -1.3482 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9784 -0.3365 -1.5717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1205 -1.2904 -0.8866 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1829 -1.2856 -1.0812 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -2.1979 -0.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5450 -3.3117 0.1172 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9157 -1.4201 0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -0.3234 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9011 -0.1739 -0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8465 -1.0694 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6901 -0.3522 1.5904 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5077 0.7525 1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4779 0.3265 -0.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2105 1.5922 -0.5088 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8453 2.1103 0.6047 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 1.2858 -1.5451 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2329 2.4773 -0.9195 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3539 -1.0492 1.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1901 1.7650 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2147 2.7108 0.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9652 2.1140 0.4224 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4993 1.4442 1.9716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7064 -0.8130 1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0998 -0.1106 0.8425 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2946 -0.4226 -1.2907 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9793 -2.2235 -0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 1.3346 -2.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7717 1.2837 -2.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6207 -1.1254 -0.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6204 0.4059 -2.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5262 -2.0220 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5754 -0.5448 -1.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8384 -2.5721 -1.2334 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0233 -3.7633 -0.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0937 -0.9065 1.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5226 -2.0557 1.2403 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0123 0.4230 -0.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 0.6940 -0.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6001 -1.4410 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4421 -1.9625 1.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3741 -1.0746 2.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0566 0.0776 2.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8905 1.5874 0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 1.2051 1.8503 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2038 -0.4051 0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9433 -0.0877 -0.9191 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7975 1.8605 0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5396 2.1540 -1.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2723 3.3034 -0.4110 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 24 26 1 0 24 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 7 35 1 6 8 36 1 0 9 37 1 0 10 38 1 0 11 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 15 43 1 6 16 44 1 0 17 45 1 0 17 46 1 0 18 47 1 0 19 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 22 53 1 0 22 54 1 0 23 55 1 0 23 56 1 0 25 57 1 0 26 58 1 0 27 59 1 0 M END