HMDB0285476 RDKit 3D PE(20:3(5Z,8Z,11Z)-O(14R,15S)/P-18:1(9Z)) 129129 0 0 0 0 0 0 0 0999 V2000 16.2878 0.5507 3.1913 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0170 0.5392 1.6697 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2244 -0.6751 1.4142 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7950 -1.0353 0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0067 -0.0986 -0.7575 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7582 0.4479 -0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8583 -0.5892 0.4028 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5272 0.0755 0.8411 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8672 0.4669 -0.4317 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7387 -0.2023 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -1.2328 0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9073 -1.1405 0.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4443 0.2218 1.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4334 1.1472 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6548 0.5013 -1.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2153 0.4865 -0.8862 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4938 0.0276 0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8917 -0.6030 1.1713 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8089 0.2024 1.6518 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6368 0.4146 1.0646 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4797 -0.6462 1.2233 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3608 -0.5082 0.2372 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2285 0.0716 -0.5237 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5026 1.3186 -0.2582 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8892 -0.5466 -1.6589 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3692 -0.6568 -1.6227 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9564 -1.3241 -0.3938 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9505 -0.2830 0.6843 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 0.0742 1.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3397 -0.5305 0.3195 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4118 -1.2824 0.9011 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8169 -1.3796 2.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2053 -0.6771 3.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1638 0.4240 3.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2574 0.5557 3.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1834 0.1485 2.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6491 1.1815 1.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3330 2.2588 1.7728 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1021 1.4531 0.9764 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1425 0.4842 1.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2023 -0.8426 0.7688 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6992 -0.7772 -0.6501 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1432 -0.3083 -0.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6529 -0.2393 -2.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7337 0.4738 -0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0762 -0.7135 -1.0167 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8643 -1.0532 -2.6191 P 0 0 0 0 0 5 0 0 0 0 0 0 0.0873 -2.3861 -2.6865 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4197 -1.5987 -3.3576 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2651 0.0666 -3.6398 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2467 1.2583 -3.4551 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6403 2.2874 -4.2176 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6602 2.0690 -5.6208 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2537 1.5625 3.5787 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2538 0.0511 3.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4658 -0.0292 3.6486 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4048 1.4877 1.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9571 0.5869 1.1224 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3018 -0.6318 2.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7917 -1.5274 1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2884 -2.0381 0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7563 -1.2706 -0.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6130 0.7410 -1.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6619 -0.6774 -1.6581 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0395 1.1282 0.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2088 1.0712 -0.8791 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4835 -1.2965 -0.4325 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1919 -1.1998 1.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8990 1.0944 1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9994 -0.3725 1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2263 1.2437 -1.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3301 0.0930 -1.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1363 -2.1717 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -1.6438 0.8038 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 -1.6669 0.1833 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9558 -1.7428 1.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1698 0.6231 1.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4714 0.1183 1.6688 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7024 1.9859 0.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 1.6634 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8809 1.1207 -2.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0419 -0.5093 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 -0.1999 -1.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7886 1.4436 -1.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 1.2381 0.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3008 -1.4656 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1756 1.3841 1.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8685 -0.5987 2.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0467 -1.6186 1.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3666 -1.4712 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6723 0.1657 -2.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7369 0.4464 -1.5849 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7709 -1.0172 -2.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8305 -1.8723 -0.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1206 -2.0923 -0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1452 0.1177 1.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2957 0.9005 1.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1533 -0.9836 -0.7168 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9634 0.4420 -0.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0702 -1.9141 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6504 -2.0782 2.4141 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -0.3786 3.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2351 -1.4112 4.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7401 1.0085 4.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7711 1.5232 3.8059 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0600 -0.7889 1.6528 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1726 -0.0740 2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9954 1.3270 0.3289 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3568 1.8701 -0.0473 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1362 0.3492 2.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1424 0.9945 1.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8471 -1.4857 1.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1924 -1.3291 0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0193 -0.1639 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6665 -1.8246 -1.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7805 -1.0800 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2849 0.6317 -0.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9648 0.3820 -2.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8090 -1.2328 -2.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6456 0.2872 -2.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1956 0.8153 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 1.2601 -0.7314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.8450 -3.9697 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1946 1.2748 -4.1721 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6276 1.6045 -2.5616 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7126 2.1457 -3.8145 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3234 3.2605 -3.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6778 0.9981 -5.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3384 2.2972 -5.9454 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 2 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 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 20 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 39 37 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 6 66 1 0 7 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 12 76 1 0 13 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 15 82 1 0 16 83 1 0 16 84 1 0 17 85 1 0 18 86 1 0 20 87 1 1 21 88 1 0 21 89 1 0 25 90 1 0 25 91 1 0 26 92 1 0 26 93 1 0 27 94 1 0 27 95 1 0 28 96 1 0 29 97 1 0 30 98 1 0 30 99 1 0 31100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 35105 1 0 36106 1 0 36107 1 0 37108 1 0 39109 1 0 40110 1 0 40111 1 0 41112 1 0 41113 1 0 42114 1 0 42115 1 0 43116 1 0 43117 1 0 44118 1 0 44119 1 0 44120 1 0 45121 1 0 45122 1 0 49123 1 0 51124 1 0 51125 1 0 52126 1 0 52127 1 0 53128 1 0 53129 1 0 M END