HMDB0285200 RDKit 3D PE(P-16:0/PGF2alpha) 129129 0 0 0 0 0 0 0 0999 V2000 -13.7739 -2.2097 -0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7907 -1.4984 0.6835 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7326 -0.0343 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7808 0.8085 -0.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6668 0.6562 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3231 1.0285 -0.7847 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2655 0.7731 -1.8269 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8745 1.1300 -1.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5482 0.3561 -0.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1882 0.6402 0.4298 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1031 0.2391 -0.5486 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7408 0.5092 0.0749 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4558 1.9493 0.3198 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2714 2.7136 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2049 2.3074 -1.8093 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2009 1.9224 -2.5491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2893 0.9647 -2.3149 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9669 0.7129 -2.5789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6503 -0.5917 -1.8243 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0640 -0.3017 -0.3495 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8698 -1.4902 0.3746 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2808 -1.1726 2.0077 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.5288 -1.9639 2.3188 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0637 -1.6368 3.0423 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 0.4633 2.1755 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5126 0.9809 3.4268 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 2.4659 3.3192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0482 3.0812 2.3643 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6422 -1.0208 -1.8334 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2578 -2.1685 -2.1215 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6475 -3.1519 -2.5219 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7731 -2.1912 -1.9037 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8669 -1.9448 -0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1675 -1.9126 0.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0773 -0.8921 -0.2945 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4469 0.1092 0.5447 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3791 1.1434 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6332 1.2100 0.9148 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1119 1.6749 2.2906 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8128 2.0886 2.2663 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3858 0.5552 3.2538 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5639 -0.1183 2.6327 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8016 -1.3797 3.1232 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0987 -0.1933 1.1579 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2017 -0.6799 0.3301 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8398 -0.0144 -0.5895 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9738 -0.6300 -1.3828 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4770 0.3734 -2.2037 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9797 -1.0681 -0.3487 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2067 -1.7070 -0.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0436 -0.8751 -1.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2471 -1.7422 -2.2164 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0377 -2.1647 -1.0122 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1199 -2.5237 -1.1231 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7704 -1.7504 -0.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5741 -3.2186 0.3857 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7729 -1.9285 1.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8110 -1.8651 0.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9611 0.3241 1.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7060 0.2360 1.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7769 0.7095 -0.8778 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7551 1.8736 -0.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6451 -0.3287 -1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8331 1.3789 -2.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0780 0.4789 0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3194 2.1208 -0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4728 1.3499 -2.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2062 -0.2845 -2.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1596 0.7632 -2.1171 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7432 2.2175 -1.2021 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2753 0.5685 0.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6178 -0.7349 -0.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0357 0.0186 1.3445 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0579 1.7050 0.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2340 0.7882 -1.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1874 -0.8363 -0.7508 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0181 0.0496 -0.6134 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6689 -0.0763 1.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1327 2.4541 0.9982 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4349 2.0143 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1092 3.7839 -0.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2834 2.7885 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7381 1.4448 -0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1014 2.4768 -3.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2751 1.5281 -2.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8592 0.4568 -3.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3436 -1.3540 -2.1882 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4581 0.4992 0.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.0150 -0.3894 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2409 -2.5843 3.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4763 0.8734 3.8068 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1883 0.5301 4.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9855 2.9593 4.2874 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9492 2.4238 2.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5403 3.3741 1.4673 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1599 2.5524 2.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1624 -3.1866 -2.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2842 -1.4476 -2.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3203 -0.9669 -0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2006 -2.6981 0.1377 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0506 -1.7731 1.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6916 -2.9242 0.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4804 -0.8632 -1.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 0.1106 1.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7708 0.8864 -0.9857 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8754 2.1390 0.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3563 1.9034 0.5155 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 2.5255 2.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6938 2.7573 2.9798 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5303 -0.1408 3.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6159 0.9478 4.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4438 0.5635 2.6125 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6431 -1.3003 3.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2575 -0.9135 1.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5353 -1.7361 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 1.0220 -0.8042 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6158 -1.5200 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4140 1.2149 -1.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2755 -0.2398 0.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4805 -1.8461 0.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8383 -1.9789 0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9379 -2.6719 -1.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4760 -0.0075 -1.2767 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5409 -0.5739 -2.7166 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8494 -1.1607 -2.9249 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8385 -2.6166 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0311 -2.5292 -1.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5284 -3.0086 -0.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1720 -1.3122 -0.3006 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 2 3 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 22 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 19 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 44 38 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 9 72 1 0 10 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 16 84 1 0 18 85 1 0 18 86 1 0 19 87 1 6 20 88 1 0 20 89 1 0 24 90 1 0 26 91 1 0 26 92 1 0 27 93 1 0 27 94 1 0 28 95 1 0 28 96 1 0 32 97 1 0 32 98 1 0 33 99 1 0 33100 1 0 34101 1 0 34102 1 0 35103 1 0 36104 1 0 37105 1 0 37106 1 0 38107 1 6 39108 1 1 40109 1 0 41110 1 0 41111 1 0 42112 1 6 43113 1 0 44114 1 1 45115 1 0 46116 1 0 47117 1 6 48118 1 0 49119 1 0 49120 1 0 50121 1 0 50122 1 0 51123 1 0 51124 1 0 52125 1 0 52126 1 0 53127 1 0 53128 1 0 53129 1 0 M END