HMDB0113459 RDKit 3D PE-NMe(20:4(8Z,11Z,14Z,17Z)/18:3(6Z,9Z,12Z)) 128127 0 0 0 0 0 0 0 0999 V2000 12.2108 1.5469 -3.4316 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0046 2.5256 -2.5317 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2487 3.7373 -2.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8246 4.3067 -1.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0152 3.8462 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8199 2.6957 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3835 1.5855 0.9615 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9885 1.4058 1.3619 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9912 1.2101 2.8405 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5300 0.1369 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9456 -1.0498 2.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5170 -1.2017 3.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4937 -1.2336 2.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 -1.1405 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8349 0.0529 0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3924 0.0154 0.8456 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7052 1.1823 0.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 1.4056 0.5933 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3273 0.3179 0.3942 C 0 0 0 0 0 0 0 0 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1 0 11 71 1 0 12 72 1 0 13 73 1 0 14 74 1 0 14 75 1 0 15 76 1 0 15 77 1 0 16 78 1 0 16 79 1 0 17 80 1 0 17 81 1 0 18 82 1 0 18 83 1 0 19 84 1 0 19 85 1 0 23 86 1 0 23 87 1 0 24 88 1 0 25 89 1 0 25 90 1 0 29 91 1 0 31 92 1 0 31 93 1 0 32 94 1 0 32 95 1 0 33 96 1 0 34 97 1 0 34 98 1 0 34 99 1 0 38100 1 0 38101 1 0 39102 1 0 39103 1 0 40104 1 0 40105 1 0 41106 1 0 41107 1 0 42108 1 0 43109 1 0 44110 1 0 44111 1 0 45112 1 0 46113 1 0 47114 1 0 47115 1 0 48116 1 0 49117 1 0 50118 1 0 50119 1 0 51120 1 0 51121 1 0 52122 1 0 52123 1 0 53124 1 0 53125 1 0 54126 1 0 54127 1 0 54128 1 0 M END