HMDB0289768 RDKit 3D PC(PGF2alpha/P-18:1(9Z)) 142142 0 0 0 0 0 0 0 0999 V2000 3.4286 8.7313 3.4198 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6242 9.9928 3.6041 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 9.8838 2.8743 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4872 8.7143 3.3958 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8448 8.5958 2.6835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6927 8.3957 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 8.2704 0.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 7.1119 0.9006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2066 5.8020 0.6313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9279 4.8638 1.4866 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2355 4.9731 2.9167 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9784 4.8877 3.7675 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2728 3.5666 3.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9806 3.5202 4.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6931 2.2008 4.2485 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8215 1.0189 4.6401 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5686 -0.2603 4.4045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -1.1608 3.5717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6137 -2.3320 3.2357 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6807 -3.1379 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3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 3 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 20 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 55 58 1 0 37 31 1 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 6 71 1 0 7 72 1 0 7 73 1 0 8 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 17 90 1 0 18 91 1 0 20 92 1 1 21 93 1 0 21 94 1 0 25 95 1 0 25 96 1 0 26 97 1 0 26 98 1 0 27 99 1 0 27100 1 0 28101 1 0 29102 1 0 30103 1 0 30104 1 0 31105 1 1 32106 1 1 33107 1 0 34108 1 0 34109 1 0 35110 1 1 36111 1 0 37112 1 6 38113 1 0 39114 1 0 40115 1 1 41116 1 0 42117 1 0 42118 1 0 43119 1 0 43120 1 0 44121 1 0 44122 1 0 45123 1 0 45124 1 0 46125 1 0 46126 1 0 46127 1 0 47128 1 0 47129 1 0 53130 1 0 53131 1 0 54132 1 0 54133 1 0 56134 1 0 56135 1 0 56136 1 0 57137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 58142 1 0 M CHG 2 51 -1 55 1 M END