HMDB0114261 RDKit 3D PE-NMe2(20:2(11Z,14Z)/22:2(13Z,16Z)) 149148 0 0 0 0 0 0 0 0999 V2000 1.4100 4.3742 -7.6811 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8012 5.7926 -8.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 6.5230 -6.6999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2116 5.8497 -5.9441 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5269 6.5636 -4.6367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3509 6.5904 -3.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2857 6.0362 -2.6026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3892 5.2920 -1.9568 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 5.8981 -0.6572 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6992 5.2523 0.4658 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2449 3.8606 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3922 3.0180 1.1259 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9947 1.5853 1.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8516 1.3729 2.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2349 1.8325 3.6297 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1384 1.6238 4.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8522 2.3790 4.2955 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 2.0788 5.4285 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4162 2.7364 5.3622 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 3.1074 -4.5273 1.5554 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9007 -3.3918 1.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -3.5557 0.5396 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8426 -4.7938 0.4366 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2806 -5.1639 -0.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -5.3695 -1.9952 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4548 -4.2282 -2.4243 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5609 -4.7237 -3.5628 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3378 1.5183 0.0395 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6082 0.3905 -0.2402 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3153 0.3430 -1.9006 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.2399 1.3242 -2.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5745 -1.2091 -2.5262 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7434 0.7770 -2.3235 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9715 -0.3781 -2.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 -0.1330 -2.6152 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 0.8476 -1.7389 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4888 2.1700 -1.8619 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3883 0.7205 -1.4007 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3442 3.8403 -7.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 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9 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 13 82 1 0 14 83 1 0 14 84 1 0 15 85 1 0 15 86 1 0 16 87 1 0 16 88 1 0 17 89 1 0 17 90 1 0 18 91 1 0 18 92 1 0 19 93 1 0 19 94 1 0 20 95 1 0 20 96 1 0 21 97 1 0 21 98 1 0 25 99 1 0 26100 1 0 26101 1 0 30102 1 0 30103 1 0 31104 1 0 31105 1 0 32106 1 0 32107 1 0 33108 1 0 33109 1 0 34110 1 0 34111 1 0 35112 1 0 35113 1 0 36114 1 0 36115 1 0 37116 1 0 37117 1 0 38118 1 0 38119 1 0 39120 1 0 40121 1 0 41122 1 0 41123 1 0 42124 1 0 43125 1 0 44126 1 0 44127 1 0 45128 1 0 45129 1 0 46130 1 0 46131 1 0 47132 1 0 47133 1 0 48134 1 0 48135 1 0 48136 1 0 49137 1 0 49138 1 0 53139 1 0 55140 1 0 55141 1 0 56142 1 0 56143 1 0 58144 1 0 58145 1 0 58146 1 0 59147 1 0 59148 1 0 59149 1 0 M END