HMDB0260714 RDKit 3D PE(14:1(9Z)/20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)) 120119 0 0 0 0 0 0 0 0999 V2000 13.5400 2.8454 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0934 1.5354 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8491 1.0827 -0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3272 -0.2268 0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1322 -0.6017 -0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9509 -0.7499 0.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6438 -0.5793 1.4645 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5918 0.4400 1.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7801 1.8393 1.3138 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7933 2.1230 -0.1324 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 1.8473 -0.9666 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3596 2.6050 -0.8011 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6234 2.4908 0.4727 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1948 1.0651 0.6819 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9809 0.5987 1.8489 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 0.2166 -0.3887 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6258 -1.1170 -0.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 -1.2851 0.3083 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8692 -2.7357 0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7805 -3.2789 -0.9964 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3677 -4.9336 -0.9103 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.1225 -5.1067 -0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9558 -5.7546 -2.2552 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1382 -5.5294 0.4681 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9302 -6.6035 0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6742 -7.1966 1.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4693 -8.3072 0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2777 -0.5370 -0.3922 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5164 0.4214 0.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 0.5653 1.4829 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.2778 -0.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4223 1.1219 -1.8938 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3564 2.0319 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7905 1.9083 -2.3338 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2334 2.0757 -1.0478 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4262 0.7136 -3.0314 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2488 -0.4625 -2.3594 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8403 1.0462 -3.3264 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8666 0.7193 -2.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2399 1.0980 -2.9507 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2838 0.7894 -2.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5971 1.1945 -2.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6546 0.9026 -1.9554 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6119 0.1634 -0.7181 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7636 -0.0976 -0.0537 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7126 -0.8588 1.2164 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.5263 -1.5547 1.3655 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9475 0.1215 2.3556 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3107 0.7234 2.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7046 1.7219 3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7624 2.8856 3.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3009 3.8040 4.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6505 2.9825 -0.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3545 2.8403 -1.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9854 3.6552 0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8616 0.7556 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8395 1.7286 1.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1514 0.9124 -1.3543 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0641 1.8349 -0.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1128 -1.0183 0.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1034 -0.0456 1.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2283 -0.7684 -1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 -1.0309 -0.6001 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 -0.4683 2.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 -1.5773 1.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3731 0.4018 2.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6413 -0.0070 1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8419 2.1830 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1461 2.5459 1.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0238 3.2605 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7130 1.6769 -0.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9137 1.8301 -2.0735 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3295 0.7501 -0.7644 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6658 2.2463 -1.6585 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5135 3.6994 -1.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6236 3.0669 0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0926 2.9531 1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5557 -1.4814 -1.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3825 -1.7637 0.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3519 -1.0026 1.3516 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -2.9025 0.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -3.3061 0.8048 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0679 -5.2066 -3.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5895 -6.2998 -0.7139 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2212 -7.3989 -0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9899 -7.5470 2.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3596 -6.3857 1.6438 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9121 -8.1245 -0.1488 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2154 -8.5983 1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 0.8789 -0.0172 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4176 2.3373 -0.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6341 0.0618 -2.1359 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6345 1.3387 -2.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9852 3.0918 -2.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1372 1.9819 -3.7051 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2548 2.8361 -2.8942 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7412 1.2497 -0.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9027 0.5603 -4.0393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1111 -0.9242 -2.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0809 1.6111 -4.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7035 0.1698 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3771 1.6491 -3.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1573 0.2395 -1.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6844 1.7566 -3.6043 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6115 1.2550 -2.3663 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7399 -0.2331 -0.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6688 0.2719 -0.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5737 -1.5753 1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7289 -2.5122 1.4226 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1402 0.8830 2.2542 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8518 -0.3647 3.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0530 -0.1058 2.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3882 1.2146 1.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7861 1.2518 4.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7147 2.1217 2.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7474 2.5611 3.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6978 3.4869 2.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7530 3.1744 5.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5184 4.4290 4.8371 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1120 4.4541 3.9809 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 2 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 2 0 14 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 2 0 21 23 1 0 21 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 18 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 2 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 2 57 1 0 3 58 1 0 3 59 1 0 4 60 1 0 4 61 1 0 5 62 1 0 6 63 1 0 7 64 1 0 7 65 1 0 8 66 1 0 8 67 1 0 9 68 1 0 9 69 1 0 10 70 1 0 10 71 1 0 11 72 1 0 11 73 1 0 12 74 1 0 12 75 1 0 13 76 1 0 13 77 1 0 17 78 1 0 17 79 1 0 18 80 1 1 19 81 1 0 19 82 1 0 23 83 1 0 25 84 1 0 25 85 1 0 26 86 1 0 26 87 1 0 27 88 1 0 27 89 1 0 31 90 1 0 31 91 1 0 32 92 1 0 32 93 1 0 33 94 1 0 33 95 1 0 34 96 1 6 35 97 1 0 36 98 1 6 37 99 1 0 38100 1 0 39101 1 0 40102 1 0 41103 1 0 42104 1 0 43105 1 0 44106 1 0 45107 1 0 46108 1 6 47109 1 0 48110 1 0 48111 1 0 49112 1 0 49113 1 0 50114 1 0 50115 1 0 51116 1 0 51117 1 0 52118 1 0 52119 1 0 52120 1 0 M END