HMDB0113732 RDKit 3D PE-NMe(24:1(15Z)/16:1(9Z)) 144143 0 0 0 0 0 0 0 0999 V2000 14.9742 0.5386 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8306 -0.9778 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0606 -1.5432 -0.7871 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6721 -0.8872 -0.7703 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8709 -1.4326 0.3753 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5043 -0.7620 0.3711 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6394 0.6912 0.5222 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0956 1.3083 1.5671 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3407 0.7205 2.6503 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9757 1.2524 2.8381 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 1.1371 1.7751 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1806 1.8504 0.4887 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2961 3.3160 0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 4.1172 1.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9224 4.2246 0.4349 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0249 3.1279 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0381 3.4141 -0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9569 1.8410 0.5647 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0502 0.8568 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3302 0.2851 1.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4989 -0.7430 1.0396 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4133 -0.6588 0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1107 0.4777 -0.2374 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3498 -1.9013 -0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5514 -1.5326 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5445 -0.6615 -0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0134 -1.3787 1.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6937 -2.6299 0.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9573 -2.5793 -0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1766 -2.0717 0.5353 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3349 -0.7287 1.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2197 0.4508 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2182 0.4151 -0.9657 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0851 1.6552 -1.7743 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3183 2.9660 -1.1539 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6865 3.2367 -0.6381 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1074 2.3607 0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1562 1.5861 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0756 1.4848 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5199 1.8595 -0.3414 C 0 0 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1 0 27 95 1 0 27 96 1 0 28 97 1 0 28 98 1 0 29 99 1 0 29100 1 0 30101 1 0 30102 1 0 31103 1 0 31104 1 0 32105 1 0 32106 1 0 33107 1 0 33108 1 0 34109 1 0 34110 1 0 35111 1 0 35112 1 0 36113 1 0 36114 1 0 37115 1 0 38116 1 0 39117 1 0 39118 1 0 40119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 42124 1 0 43125 1 0 43126 1 0 44127 1 0 44128 1 0 45129 1 0 45130 1 0 46131 1 0 46132 1 0 46133 1 0 47134 1 0 47135 1 0 51136 1 0 53137 1 0 53138 1 0 54139 1 0 54140 1 0 55141 1 0 56142 1 0 56143 1 0 56144 1 0 M END