HMDB0113498 RDKit 3D PE-NMe(20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) 128127 0 0 0 0 0 0 0 0999 V2000 -6.3370 2.4808 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1213 3.0184 -0.8687 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 4.0932 -1.7544 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2315 5.3264 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2281 5.8911 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1002 6.5246 -1.5364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8725 6.2022 -1.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 5.1685 -0.5456 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4738 4.2719 -1.4257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6434 2.9994 -1.5037 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6395 2.2617 -0.6877 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8629 1.2746 0.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0169 -0.0043 -0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0168 -0.6039 -0.9301 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2335 -1.4416 -1.8742 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4401 -2.7131 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4327 -3.4677 -1.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0008 -4.5795 -0.4058 C 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 11 72 1 0 11 73 1 0 12 74 1 0 13 75 1 0 14 76 1 0 14 77 1 0 15 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 42107 1 0 43108 1 0 43109 1 0 44110 1 0 45111 1 0 46112 1 0 46113 1 0 47114 1 0 48115 1 0 49116 1 0 49117 1 0 50118 1 0 51119 1 0 52120 1 0 52121 1 0 53122 1 0 54123 1 0 55124 1 0 55125 1 0 56126 1 0 56127 1 0 56128 1 0 M END