HMDB0292561 RDKit 3D CDP-DG(22:5(7Z,10Z,13Z,16Z,19Z)/PGF2alpha) 162164 0 0 0 0 0 0 0 0999 V2000 18.7542 -1.8245 -3.7488 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6115 -0.8329 -2.5764 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4738 -1.3188 -1.4972 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0879 -1.6885 -0.3267 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7789 -1.7496 0.2654 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5696 -1.4287 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7635 -0.4477 -0.1424 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0691 0.4470 1.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0309 0.3586 2.0471 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2924 1.3496 2.4999 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3632 2.7261 2.0748 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2555 3.4150 1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0919 2.9778 1.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6157 1.5902 1.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4899 1.4236 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3359 0.9170 1.9248 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9606 0.4290 0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7362 1.2082 0.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5436 1.0117 1.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1129 -0.4150 1.1394 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9892 -0.6277 2.0847 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 0.0942 1.7945 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6944 -0.3656 2.3611 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5844 1.1948 1.0075 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3801 1.8337 0.7709 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3515 1.0745 -0.0240 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0937 1.9913 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6714 1.5357 1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2149 2.1660 1.1202 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.4543 2.8672 2.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5081 3.2877 -0.1114 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3515 0.9168 0.9826 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2503 -0.1695 2.2484 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.0470 -1.0699 2.1631 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0352 0.7691 3.6657 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6162 -1.0922 2.4904 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9508 -1.9412 1.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0343 -1.1473 0.6419 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3690 -1.9735 -0.3787 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1487 -1.5612 -1.6883 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9549 -2.4915 -2.4966 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2165 -2.8173 -2.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9956 -3.6742 -2.9115 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4500 -4.2308 -4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2143 -5.1202 -4.8584 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1884 -3.8885 -4.3479 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -3.0410 -3.6041 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2663 -2.8313 -4.0298 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4225 -0.1238 -1.9055 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2243 0.6800 -2.3616 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4326 0.1094 -3.4527 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2258 -0.4366 -3.3439 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 0.0517 -2.4469 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5484 -1.1638 -1.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0572 -1.0791 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3865 -1.1858 -0.1751 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1941 -2.2712 0.4165 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9968 -0.1574 0.5127 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6183 0.2769 -2.6873 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.9714 -0.6061 -3.7027 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8349 0.6126 -1.9222 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6809 1.3314 -0.6014 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.5545 2.4162 -0.6534 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9936 0.4559 0.5481 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3149 0.5026 1.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2169 1.4495 1.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5016 1.2207 1.9533 C 0 0 1 0 0 0 0 0 0 0 0 0 -12.4667 1.7817 3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6737 1.8102 1.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8875 1.2216 -0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2176 -0.2099 -0.2614 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5026 -0.7000 0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7475 -0.5568 1.7588 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8942 0.3218 1.5996 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0263 1.3906 1.5081 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1784 -0.9744 1.5810 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7285 -1.1930 2.9149 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3950 -2.8336 -3.3968 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1749 -1.4987 -4.6232 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8228 -1.9458 -3.9964 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6034 -0.6205 -2.3318 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1084 0.1073 -3.0315 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5944 -1.3806 -1.6922 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9223 -2.0360 0.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6777 -2.8937 0.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7861 -1.3313 1.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2464 -2.0653 -1.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8535 -0.2635 -0.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0458 1.4951 0.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1051 0.3831 1.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8551 -0.6413 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5560 1.0786 3.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6282 3.3405 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3111 2.9129 1.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4397 4.5032 1.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3824 3.7079 0.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1583 1.3473 0.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3615 0.8042 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6231 1.7559 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5765 0.8450 2.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6833 0.5020 -0.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -0.6727 0.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4846 0.9860 -0.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0155 2.2767 0.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8024 1.4732 2.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7461 1.6589 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7794 -0.7133 0.1067 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9731 -1.0921 1.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -0.3621 3.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7434 -1.7362 2.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9453 2.1930 1.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 2.7879 0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7509 0.9909 -1.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4282 3.0384 0.1098 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3465 1.9036 -1.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5408 4.2161 0.2346 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1335 0.1800 4.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1428 -2.1318 0.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4429 -2.8394 1.8729 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4657 -0.2299 0.4041 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0827 -1.7828 -1.9061 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6609 -2.4114 -1.2821 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0144 -3.9444 -2.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7673 -4.7501 -5.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2418 -6.1454 -4.6828 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6323 0.3765 -0.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6395 1.6930 -2.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5703 0.9440 -1.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8752 0.1313 -4.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9733 -1.3085 -3.9416 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 0.7335 -1.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3799 0.6185 -3.0056 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0404 -1.3285 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -2.0496 -2.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3856 -1.9502 -2.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3466 -0.1342 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3298 1.2255 -3.2488 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9518 -0.2311 -4.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4704 1.2437 -2.6167 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5262 -0.2545 -1.7136 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6827 1.8495 -0.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3884 2.9539 -1.4616 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0159 -0.6253 0.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6162 -0.4139 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0741 2.3837 0.6679 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6543 0.1386 2.0405 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7075 1.0958 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4946 2.9248 1.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5605 1.7405 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7721 1.7863 -0.5944 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0561 1.4689 -0.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2474 -0.4377 -1.3801 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3455 -0.8632 0.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3154 -0.2065 -0.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6498 -1.8033 0.0609 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3185 -1.4631 2.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8234 -0.5376 2.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3904 0.3282 2.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4069 0.4217 2.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4717 1.4766 2.3397 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8972 -1.8229 1.3805 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4581 -1.0815 3.5540 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 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 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 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 33 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 2 0 43 44 1 0 44 45 1 0 44 46 2 0 46 47 1 0 47 48 2 0 40 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 56 58 1 0 49 59 1 0 59 60 1 0 59 61 1 0 61 62 1 0 62 63 1 0 62 64 1 0 64 65 1 0 65 66 2 0 66 67 1 0 67 68 1 0 67 69 1 0 69 70 1 0 70 71 1 0 71 72 1 0 72 73 1 0 64 74 1 0 74 75 1 0 74 76 1 0 76 77 1 0 58 26 1 0 76 38 1 0 47 41 1 0 1 78 1 0 1 79 1 0 1 80 1 0 2 81 1 0 2 82 1 0 3 83 1 0 4 84 1 0 5 85 1 0 5 86 1 0 6 87 1 0 7 88 1 0 8 89 1 0 8 90 1 0 9 91 1 0 10 92 1 0 11 93 1 0 11 94 1 0 12 95 1 0 13 96 1 0 14 97 1 0 14 98 1 0 15 99 1 0 16100 1 0 17101 1 0 17102 1 0 18103 1 0 18104 1 0 19105 1 0 19106 1 0 20107 1 0 20108 1 0 21109 1 0 21110 1 0 25111 1 0 25112 1 0 26113 1 6 27114 1 0 27115 1 0 31116 1 0 35117 1 0 37118 1 0 37119 1 0 38120 1 6 40121 1 6 42122 1 0 43123 1 0 45124 1 0 45125 1 0 49126 1 1 50127 1 0 50128 1 0 51129 1 0 52130 1 0 53131 1 0 53132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 59137 1 6 60138 1 0 61139 1 0 61140 1 0 62141 1 1 63142 1 0 64143 1 6 65144 1 0 66145 1 0 67146 1 1 68147 1 0 69148 1 0 69149 1 0 70150 1 0 70151 1 0 71152 1 0 71153 1 0 72154 1 0 72155 1 0 73156 1 0 73157 1 0 73158 1 0 74159 1 1 75160 1 0 76161 1 6 77162 1 0 M END