HMDB0284403 RDKit 3D PE(20:5(5Z,8Z,10E,14Z,17Z)-OH(12)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) 130129 0 0 0 0 0 0 0 0999 V2000 -14.5929 6.6888 -0.9833 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5972 5.1704 -0.7562 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2051 4.7128 -0.8889 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7332 3.8470 -1.7732 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5721 3.2183 -2.7634 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7893 1.7892 -2.8416 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3588 0.8493 -2.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5254 0.9729 -0.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2515 0.3321 0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7543 -0.6551 1.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4229 -1.2371 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5346 -1.1289 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4025 -0.4817 1.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7964 0.2336 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4625 -0.1170 0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 -1.0583 0.6888 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8175 -2.0735 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0048 -2.1457 2.8784 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0766 -1.3912 3.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5624 -0.1666 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0812 -0.2632 2.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -1.4033 1.6626 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5601 -2.2167 1.2697 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4175 -1.5758 1.2787 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -2.5278 0.5060 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2852 -3.2394 1.3593 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0745 -2.1660 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1966 -2.2617 2.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6415 -3.3603 2.9236 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8949 -1.0044 2.9725 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3653 -0.2044 1.8079 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3846 -0.8788 0.9273 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6239 -1.1944 1.6416 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7657 -0.6470 1.2715 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 0.3137 0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8888 -0.2970 -0.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0006 0.2796 -1.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3704 1.5760 -0.6365 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5340 2.1419 -1.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8868 3.4567 -0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9766 3.9494 0.4252 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3082 3.4190 0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3785 2.4150 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1272 1.3549 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0999 0.8412 0.2108 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3429 1.4854 -1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4859 2.0296 -1.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7149 2.0704 -0.6299 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8154 1.3297 -1.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0464 -2.0078 -0.6974 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5003 -3.1077 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3858 -2.7110 -2.7146 P 0 0 0 0 0 5 0 0 0 0 0 0 2.6551 -2.0010 -2.2362 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6065 -1.6727 -3.7668 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8907 -4.0801 -3.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2329 -5.1098 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6843 -6.3329 -3.4214 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0243 -7.3617 -2.4409 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.5782 7.1005 -0.7985 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2795 7.2068 -0.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8679 6.9312 -2.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8261 5.0864 0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3629 4.6461 -1.2958 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4364 5.1122 -0.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6160 3.6518 -1.7433 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2327 3.5940 -3.8294 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5935 3.7269 -2.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4314 1.4369 -3.7188 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6379 -0.2019 -2.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4358 2.0172 -0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5247 0.6069 -1.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2288 0.7167 0.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3472 -1.0724 1.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6455 -2.3699 0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9857 -1.0286 -0.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9252 -1.6586 2.7925 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8908 -0.4832 2.9126 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4977 0.2479 -0.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7721 1.3791 1.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0741 0.5521 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6938 -1.1002 0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8832 -2.2593 1.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5865 -3.1173 1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2328 -3.0506 3.5336 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6072 -1.6938 4.3176 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0472 0.1986 1.8469 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6383 0.6903 3.5374 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6566 0.6785 2.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6288 -0.4495 3.5393 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5356 -3.2788 0.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2097 -3.7984 2.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8055 -3.8961 0.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7075 -1.2428 3.6885 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 -0.3979 3.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7277 0.7844 2.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4561 0.0496 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 -1.9072 0.7118 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4391 -0.4124 -0.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6474 -1.8907 2.5016 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 -0.9055 1.8316 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3006 1.2479 0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 0.5069 -0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6406 -1.2665 -1.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6599 -0.2273 -1.8288 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8039 2.1664 0.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1824 1.6300 -1.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8697 4.1747 -1.3593 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2580 3.9047 1.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0606 3.4190 -0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3768 4.4541 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6956 2.5999 1.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9844 0.7434 2.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7442 -0.2358 -0.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0494 0.6322 0.7721 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5327 1.5141 -1.8024 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5285 2.4858 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6653 1.6316 0.3589 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1156 3.1329 -0.5696 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7399 1.4833 -0.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9622 1.8799 -2.3451 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5593 0.2669 -1.5219 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8046 -1.4073 -0.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7166 -1.4358 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6849 -1.9429 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -4.7940 -1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3247 -5.3581 -2.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5747 -6.1283 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -6.7791 -4.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2002 -7.9131 -2.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -6.9806 -1.6797 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 25 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 16 81 1 0 17 82 1 0 17 83 1 0 18 84 1 0 19 85 1 0 20 86 1 0 20 87 1 0 21 88 1 0 21 89 1 0 25 90 1 6 26 91 1 0 26 92 1 0 30 93 1 0 30 94 1 0 31 95 1 0 31 96 1 0 32 97 1 0 32 98 1 0 33 99 1 0 34100 1 0 35101 1 0 35102 1 0 36103 1 0 37104 1 0 38105 1 0 39106 1 0 40107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 47116 1 0 48117 1 0 48118 1 0 49119 1 0 49120 1 0 49121 1 0 50122 1 0 50123 1 0 54124 1 0 56125 1 0 56126 1 0 57127 1 0 57128 1 0 58129 1 0 58130 1 0 M END