HMDB0286201 RDKit 3D PC(17:0/20:3(6,8,11)-OH(5)) 140139 0 0 0 0 0 0 0 0999 V2000 5.5266 -9.4155 2.8355 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4162 -8.4538 2.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8925 -7.0425 2.3297 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5129 -6.5956 3.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0346 -5.1700 3.5857 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9558 -4.1817 3.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5209 -2.7860 3.3085 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5916 -2.5475 2.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0868 -1.1270 2.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5840 -0.2608 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 1.1664 3.2795 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9127 2.0625 3.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 2.9449 3.8294 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2793 3.8060 3.4872 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8085 4.6839 4.3357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6572 5.5379 3.9776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9369 5.9433 5.1045 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7729 4.9908 2.9125 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1302 3.6827 3.2057 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2827 3.3178 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1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 24 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 53 56 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 6 69 1 0 7 70 1 0 7 71 1 0 8 72 1 0 8 73 1 0 9 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 13 79 1 0 14 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 20 88 1 0 20 89 1 0 24 90 1 1 25 91 1 0 25 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 40116 1 0 41117 1 0 41118 1 0 42119 1 0 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 54132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 56140 1 0 M CHG 2 49 -1 53 1 M END