HMDB0287768 RDKit 3D PC(20:4(5Z,8Z,11Z,14Z)-OH(20)/22:0) 153152 0 0 0 0 0 0 0 0999 V2000 6.2025 4.5351 2.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3197 4.0722 1.4793 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8814 3.1085 0.4941 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2977 1.7597 0.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3547 1.6935 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7312 0.3452 2.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2837 -0.6941 1.6273 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6541 -1.4479 0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -2.2844 0.8022 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -1.7789 1.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4331 -1.0301 0.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1187 -0.4813 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4023 0.2777 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0228 -0.6151 -1.6646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0647 -1.6810 -1.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7308 -2.5127 -2.5056 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3223 -3.5628 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6665 -4.3540 -3.3033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6985 -5.3880 -3.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6156 -6.5934 -2.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -6.4638 -0.9722 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6525 -5.7815 -0.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5124 -6.4520 0.3437 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8106 -4.4327 -0.3113 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7756 -3.6210 0.2933 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6028 -2.9584 -0.8052 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7995 -2.2648 -1.7107 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1968 -1.5710 -2.8176 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4212 -1.5092 -3.0665 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2216 -0.9194 -3.7103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8158 -0.3317 -4.9348 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7499 0.8379 -4.7187 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9211 1.9272 -4.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1285 2.5091 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1716 2.2217 -2.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 3.1947 -1.6897 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4285 4.3989 -2.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 5.2293 -3.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3528 6.5557 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2498 7.1618 -2.3927 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 6.6593 -2.6441 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0978 6.9846 -1.4295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4758 6.2148 -0.6468 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3733 4.7502 -0.7535 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9264 4.0881 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8472 2.6021 0.4426 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3564 1.9805 1.7494 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7772 2.3533 2.0459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1778 1.7683 3.2706 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1476 -2.5626 1.1482 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3688 -3.1454 2.1608 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6173 -1.9669 3.1060 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.6422 -1.0230 3.6205 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5178 -1.0768 2.1471 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.7856 -2.6680 4.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3653 -3.3349 3.9329 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -3.9570 5.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3153 -4.6371 4.5449 N 0 0 0 0 0 4 0 0 0 0 0 0 1.8906 -5.6936 3.6533 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1863 -3.7410 3.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1172 -5.2064 5.5851 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0034 5.6620 2.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2834 4.4275 2.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9514 4.1655 3.5919 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9391 4.9536 0.9014 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3953 3.6326 1.9791 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0335 2.9033 -0.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6986 3.6182 -0.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3416 1.2794 1.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6821 1.1470 0.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8928 2.1849 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2349 2.3522 1.7696 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4583 0.4996 3.3446 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8253 -0.0406 3.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3419 -0.3375 1.2328 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6966 -1.5262 2.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6126 -0.8352 -0.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4779 -2.2156 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -2.9904 1.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 -3.0421 -0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5157 -2.7060 1.3277 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0447 -1.2343 2.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9401 -0.2724 -0.4615 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1047 -1.7961 -0.6957 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4947 -1.3282 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2267 0.2200 1.4535 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1524 0.9905 -0.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5481 0.8615 -0.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -1.0485 -2.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5207 0.0529 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3973 -2.3083 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0834 -1.2430 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6168 -3.0107 -2.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2176 -1.8287 -3.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.9350 -1.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0243 -4.0676 -1.1999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8635 -3.6453 -4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2925 -4.8718 -3.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7071 -4.8699 -3.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8396 -5.7585 -4.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6343 -7.1260 -2.7357 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3669 -7.3862 -2.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5658 -6.0850 -0.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6146 -7.5574 -0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4878 -4.2171 0.9237 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1046 -3.8199 -1.3389 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -2.2712 -0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -0.1422 -3.1315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4549 -1.6617 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3218 -1.1396 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9522 -0.0231 -5.5984 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1207 1.1728 -5.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6015 0.5331 -4.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0562 2.2593 -4.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3377 3.2831 -2.7798 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6965 1.2771 -2.3855 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 1.8665 -1.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 2.8006 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3302 4.9158 -1.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8213 4.7492 -3.4785 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4375 5.4442 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2685 7.1769 -2.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2233 8.2359 -2.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4216 7.2291 -3.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 5.5985 -2.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0705 8.0966 -1.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9234 6.6400 0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2555 4.5152 -0.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7352 4.3251 -1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9975 4.4005 0.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 4.4940 1.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7634 2.3025 0.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4298 2.1404 -0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3129 0.8727 1.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 2.2124 2.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8732 3.4456 2.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 1.9876 1.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1376 1.9345 3.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9753 -1.9469 1.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5211 -1.8582 0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9628 -2.5539 3.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 -4.0606 3.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5419 -4.6699 5.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4914 -3.1519 5.7185 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7874 -6.3664 3.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0643 -6.2962 4.0254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7276 -5.2370 2.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6766 -3.4644 2.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5354 -2.8852 4.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0603 -4.3750 3.4771 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4555 -4.4477 6.3325 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -6.0383 6.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0524 -5.6049 5.0986 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 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 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 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 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 58 59 1 0 58 60 1 0 58 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 3 68 1 0 4 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 6 74 1 0 7 75 1 0 7 76 1 0 8 77 1 0 8 78 1 0 9 79 1 0 9 80 1 0 10 81 1 0 10 82 1 0 11 83 1 0 11 84 1 0 12 85 1 0 12 86 1 0 13 87 1 0 13 88 1 0 14 89 1 0 14 90 1 0 15 91 1 0 15 92 1 0 16 93 1 0 16 94 1 0 17 95 1 0 17 96 1 0 18 97 1 0 18 98 1 0 19 99 1 0 19100 1 0 20101 1 0 20102 1 0 21103 1 0 21104 1 0 25105 1 1 26106 1 0 26107 1 0 30108 1 0 30109 1 0 31110 1 0 31111 1 0 32112 1 0 32113 1 0 33114 1 0 34115 1 0 35116 1 0 35117 1 0 36118 1 0 37119 1 0 38120 1 0 38121 1 0 39122 1 0 40123 1 0 41124 1 0 41125 1 0 42126 1 0 43127 1 0 44128 1 0 44129 1 0 45130 1 0 45131 1 0 46132 1 0 46133 1 0 47134 1 0 47135 1 0 48136 1 0 48137 1 0 49138 1 0 50139 1 0 50140 1 0 56141 1 0 56142 1 0 57143 1 0 57144 1 0 59145 1 0 59146 1 0 59147 1 0 60148 1 0 60149 1 0 60150 1 0 61151 1 0 61152 1 0 61153 1 0 M CHG 2 54 -1 58 1 M END