HMDB0266113 RDKit 3D PA(22:5(7Z,10Z,13Z,16Z,19Z)/5-iso PGF2VI) 124124 0 0 0 0 0 0 0 0999 V2000 -14.1359 -3.1958 2.3191 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9559 -2.4577 2.9728 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8602 -1.0890 2.4942 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8629 -0.5706 1.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5847 -1.1020 1.4354 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1778 -2.4412 1.7697 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9837 -3.3367 0.8383 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1066 -3.2421 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8244 -3.5619 -1.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0820 -2.9403 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2772 -1.6523 -2.7125 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4728 -0.8576 -2.5111 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4601 0.3327 -1.9721 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2605 1.0358 -1.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1648 2.2979 -2.2584 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1554 2.6333 -2.9811 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9551 1.8129 -3.1487 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7877 2.6484 -2.6275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4669 1.9666 -2.7413 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3278 0.6800 -2.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5318 0.8301 -0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5303 1.7856 -0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7981 3.0189 -0.0727 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2883 1.4690 0.5171 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4204 2.5180 0.9559 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8655 2.1142 1.5033 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6047 3.4689 1.8466 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8515 4.0337 0.6018 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6669 5.4947 0.6791 P 0 0 0 0 0 5 0 0 0 0 0 0 1.7763 6.6875 0.7994 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5271 5.6540 -0.7947 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7816 5.5464 1.9675 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 1.3802 0.6827 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4806 0.3155 1.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4227 -0.1016 2.2755 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 -0.3547 0.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4895 -1.0287 0.8023 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7515 -0.7320 0.6591 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2237 0.3261 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8934 1.4493 0.4649 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3570 2.5146 -0.5168 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2590 3.1534 -1.0929 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1552 3.4229 0.3716 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8707 2.4902 1.3166 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8088 2.9735 2.6259 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1361 1.1443 1.2074 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0303 0.1440 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3710 -0.9854 1.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2997 -1.9354 0.3709 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4351 -2.9825 -0.0231 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3095 -2.4784 1.3106 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3805 -3.3587 0.8676 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2358 -4.6627 0.2441 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6135 -4.8408 -1.0759 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3105 -4.0262 -2.1591 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6960 -3.9638 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7195 -3.7446 3.0755 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8038 -2.4830 1.7888 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2748 -2.3762 4.0659 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0887 -3.0885 2.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7765 -0.4298 2.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0254 0.5281 1.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4295 -0.9121 0.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7281 -0.4195 1.8421 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9815 -2.6955 2.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6744 -4.3402 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7942 -4.1167 -0.9094 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6418 -2.3715 -0.9755 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -4.5870 -0.9307 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1167 -3.5022 -2.3835 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3285 -1.0318 -2.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2201 -1.8623 -3.8659 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4661 -1.2735 -2.8771 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4148 0.8706 -1.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3465 0.4611 -1.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4804 1.3234 -0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0342 2.9687 -2.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1742 3.6129 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9527 0.8139 -2.7575 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7274 1.7070 -4.2571 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7433 3.5425 -3.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9984 3.0546 -1.6326 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2246 1.8490 -3.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6947 2.6956 -2.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2761 0.3394 -2.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9743 -0.1176 -2.4317 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3685 -0.1688 -0.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5787 1.1911 -0.3482 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 3.2762 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0138 3.0028 1.7975 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7765 1.6107 2.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 4.0803 2.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4911 3.2626 2.4442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8509 5.5119 -1.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3952 6.2980 1.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6998 0.3617 -0.6612 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8035 -1.1415 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2365 -1.8319 1.4983 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5225 -1.2724 1.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0156 -0.2079 -0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4726 0.7270 -0.9339 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1742 1.9943 1.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9827 2.0583 -1.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8983 2.5559 -1.7865 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8709 4.0109 -0.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4805 4.1159 0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9252 2.4005 0.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3098 3.8245 2.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9375 0.8206 2.2651 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3933 0.4013 -0.4324 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0239 -1.2577 2.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6745 -1.4216 -0.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7918 -2.5623 -0.6672 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7528 -1.5519 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7620 -2.9659 2.2039 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1181 -2.7058 0.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1029 -3.5242 1.7738 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6281 -5.3133 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2478 -5.2028 0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 -4.8016 -1.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8979 -5.9272 -1.4005 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2224 -2.9487 -1.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3572 -4.3703 -2.2619 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7477 -4.1877 -3.0920 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 26 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 46 40 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 10 70 1 0 11 71 1 0 11 72 1 0 12 73 1 0 13 74 1 0 14 75 1 0 14 76 1 0 15 77 1 0 16 78 1 0 17 79 1 0 17 80 1 0 18 81 1 0 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 21 87 1 0 21 88 1 0 25 89 1 0 25 90 1 0 26 91 1 1 27 92 1 0 27 93 1 0 31 94 1 0 32 95 1 0 36 96 1 0 36 97 1 0 37 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 1 41103 1 6 42104 1 0 43105 1 0 43106 1 0 44107 1 6 45108 1 0 46109 1 1 47110 1 0 48111 1 0 49112 1 6 50113 1 0 51114 1 0 51115 1 0 52116 1 0 52117 1 0 53118 1 0 53119 1 0 54120 1 0 54121 1 0 55122 1 0 55123 1 0 55124 1 0 M END