HMDB0112993 RDKit 3D PE-NMe(14:0/22:4(7Z,10Z,13Z,16Z)) 128127 0 0 0 0 0 0 0 0999 V2000 11.3790 6.0798 0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9110 5.6943 -0.7835 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5732 4.2742 -1.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 4.0663 -1.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 2.6169 -1.4506 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3143 1.6929 -0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6308 0.8815 0.2697 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1650 0.7754 0.2762 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7443 1.0431 1.6944 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0973 0.1833 2.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7495 -1.1506 1.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4174 -2.2597 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8213 -3.2656 3.0772 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3536 -3.4990 3.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0722 -4.7858 2.3666 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3065 -4.8994 1.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4964 -4.0529 0.5166 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2866 -2.6082 0.7587 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3363 -2.1510 -0.3848 C 0 0 0 0 0 0 0 0 0 0 0 0 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12 72 1 0 13 73 1 0 14 74 1 0 14 75 1 0 15 76 1 0 16 77 1 0 17 78 1 0 17 79 1 0 18 80 1 0 18 81 1 0 19 82 1 0 19 83 1 0 20 84 1 0 20 85 1 0 21 86 1 0 21 87 1 0 25 88 1 0 26 89 1 0 26 90 1 0 30 91 1 0 30 92 1 0 31 93 1 0 31 94 1 0 32 95 1 0 32 96 1 0 33 97 1 0 33 98 1 0 34 99 1 0 34100 1 0 35101 1 0 35102 1 0 36103 1 0 36104 1 0 37105 1 0 37106 1 0 38107 1 0 38108 1 0 39109 1 0 39110 1 0 40111 1 0 40112 1 0 41113 1 0 41114 1 0 42115 1 0 42116 1 0 42117 1 0 43118 1 0 43119 1 0 47120 1 0 49121 1 0 49122 1 0 50123 1 0 50124 1 0 51125 1 0 52126 1 0 52127 1 0 52128 1 0 M END