HMDB0287932 RDKit 3D PC(20:5(5Z,8Z,10E,14Z,17Z)-OH(12)/22:1(13Z)) 149148 0 0 0 0 0 0 0 0999 V2000 -4.2916 -7.7101 5.5038 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4406 -7.6211 3.9844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8442 -8.8426 3.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8175 -8.8596 2.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1021 -7.6475 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7049 -7.6984 2.5833 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3095 -7.7479 1.7774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2218 -7.7664 0.3267 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8762 -6.5663 -0.3316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8517 -6.5595 -1.6924 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1565 -6.2173 0.2578 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8808 -5.1973 -0.2455 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1463 -4.8515 0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9088 -3.8809 -0.1164 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6109 -3.0803 -1.2325 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3842 -1.6346 -1.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2754 -0.9004 -0.1238 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3354 -1.2964 1.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9973 -1.0012 1.9849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6734 0.4706 1.9159 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3522 0.7281 2.5571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0051 1.9462 2.7771 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4546 -0.2459 2.9433 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7834 0.0320 3.5503 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7584 0.8149 2.7695 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8812 1.3888 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5147 2.3270 2.7807 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7457 3.1525 3.6253 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.6719 2.2351 4.3478 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0952 4.2754 4.6964 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.6280 3.9617 2.4141 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9083 4.2563 2.7953 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6334 4.9447 1.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0904 6.1804 1.2385 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.1080 7.1961 0.9561 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0811 6.7446 2.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4284 5.9626 -0.0547 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2812 0.2613 1.6065 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1376 0.7885 0.3431 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4324 1.8563 0.2671 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7051 0.2672 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9464 -0.8408 -1.5369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5352 -1.2756 -2.8724 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4378 -0.1396 -3.8854 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9639 -0.4788 -5.2351 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6493 0.5945 -6.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2325 0.6028 -6.7546 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1605 0.6552 -5.7493 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 0.6528 -6.2973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1969 0.5411 -5.0815 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2294 1.6964 -4.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 2.8732 -4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0368 3.2203 -3.8419 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2416 2.3790 -2.6521 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1063 3.1517 -1.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2662 4.1165 -1.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0477 4.8815 0.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2954 5.6538 0.5198 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4464 4.6735 0.7633 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9791 3.7395 1.8346 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 2.6551 2.2197 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4279 -8.3853 5.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1888 -8.1067 5.9907 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0353 -6.7402 5.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -7.7145 3.8314 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1852 -6.6708 3.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -9.8178 3.7401 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4487 -9.8120 2.2674 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5293 -6.7193 2.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 -7.6472 1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5508 -7.7006 3.6845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3057 -7.7859 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8789 -8.6409 -0.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7444 -7.9870 -0.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1542 -5.7124 -0.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7903 -5.6103 -2.0119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5681 -6.7296 1.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4222 -4.7009 -1.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 -5.4421 1.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8561 -3.7572 0.4366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5016 -3.2015 -1.9685 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7965 -3.5434 -1.9176 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -1.0829 -2.1777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1203 0.2160 -0.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7338 -2.2471 1.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -0.5365 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -1.5547 1.5817 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -1.1920 3.0542 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6936 0.8862 0.8824 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4414 0.9899 2.5255 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5241 0.6570 4.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2494 -0.8839 3.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2162 1.7635 2.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6515 0.6082 3.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5116 1.8414 4.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0132 4.7650 3.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4384 3.2664 2.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6460 4.2011 0.8307 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7188 5.0550 1.9659 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8050 7.3263 1.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5649 8.1494 0.8063 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6098 6.9599 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1268 6.1902 2.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8233 7.7966 1.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5341 6.9063 3.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9992 5.1732 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3927 6.9018 -0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4107 5.5932 0.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 1.0670 -1.6019 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7016 -0.2043 -0.5863 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9004 -0.4804 -1.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8776 -1.7413 -0.9055 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9174 -2.1104 -3.2488 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5752 -1.6231 -2.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6008 0.4832 -3.8255 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3416 0.5419 -3.4759 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -0.7508 -5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4271 -1.4253 -5.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3637 0.5741 -7.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8353 1.6130 -5.7556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1347 -0.2733 -7.4561 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1084 1.4988 -7.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1659 -0.2364 -5.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2632 1.5956 -5.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5339 1.5836 -6.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3632 -0.1909 -6.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9597 -0.4251 -4.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2337 0.4181 -5.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2867 1.4837 -3.0852 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1352 2.1159 -4.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7264 3.3945 -5.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 4.0430 -4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9201 1.3560 -2.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4237 2.2117 -2.6978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 2.5680 -0.4864 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2079 3.8453 -1.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3809 4.8230 -1.9911 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 3.5022 -1.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5702 4.3669 0.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3096 5.7081 -0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1397 6.1998 1.4645 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6261 6.3583 -0.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7502 4.1397 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 5.2803 1.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 3.2354 1.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7696 4.3428 2.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9060 3.0092 2.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4424 2.0851 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0888 1.9139 1.3898 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 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 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 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 34 37 1 0 25 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 0 7 72 1 0 8 73 1 0 8 74 1 0 9 75 1 0 10 76 1 0 11 77 1 0 12 78 1 0 13 79 1 0 14 80 1 0 15 81 1 0 15 82 1 0 16 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 20 89 1 0 20 90 1 0 24 91 1 0 24 92 1 0 25 93 1 6 26 94 1 0 26 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 35100 1 0 35101 1 0 35102 1 0 36103 1 0 36104 1 0 36105 1 0 37106 1 0 37107 1 0 37108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 43113 1 0 43114 1 0 44115 1 0 44116 1 0 45117 1 0 45118 1 0 46119 1 0 46120 1 0 47121 1 0 47122 1 0 48123 1 0 48124 1 0 49125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 52131 1 0 53132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 56137 1 0 56138 1 0 57139 1 0 57140 1 0 58141 1 0 58142 1 0 59143 1 0 59144 1 0 60145 1 0 60146 1 0 61147 1 0 61148 1 0 61149 1 0 M CHG 2 30 -1 34 1 M END