HMDB0289571 RDKit 3D PC(P-18:0/20:3(8Z,11Z,14Z)-2OH(5,6)) 143142 0 0 0 0 0 0 0 0999 V2000 0.1401 -4.9128 8.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8005 -5.0515 7.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9357 -3.8704 6.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4194 -2.6227 6.9424 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5391 -1.5001 5.8651 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4954 -2.0096 4.8943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2116 -2.1751 3.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9115 -1.8788 2.9758 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0612 -0.9378 1.8611 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7761 -1.2192 0.6181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2729 -2.4245 -0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0481 -3.6022 0.7521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0936 -4.2440 0.9764 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 -3.7659 0.4016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2597 -3.4182 1.5659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4662 -4.5406 2.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5776 -2.8195 1.1875 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2293 -2.3877 2.3255 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -1.7333 0.1760 C 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 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 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 44 45 1 0 25 46 1 0 46 47 1 0 47 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 1 0 54 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 18 84 1 0 19 85 1 0 19 86 1 0 20 87 1 0 20 88 1 0 21 89 1 0 21 90 1 0 25 91 1 6 26 92 1 0 26 93 1 0 28 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 36108 1 0 36109 1 0 37110 1 0 37111 1 0 38112 1 0 38113 1 0 39114 1 0 39115 1 0 40116 1 0 40117 1 0 41118 1 0 41119 1 0 42120 1 0 42121 1 0 43122 1 0 43123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 45128 1 0 46129 1 0 46130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 55135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 56140 1 0 57141 1 0 57142 1 0 57143 1 0 M CHG 2 50 -1 54 1 M END