HMDB0284468 RDKit 3D PE(24:0/PGD2) 152152 0 0 0 0 0 0 0 0999 V2000 -1.8924 -6.3288 9.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7015 -6.1842 7.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9205 -5.9232 6.6091 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0991 -4.6516 6.6777 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4112 -4.5074 5.3545 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4728 -3.2603 5.2613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5738 -3.2362 6.2472 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4015 -2.0179 6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1238 -1.5056 5.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3367 -0.9927 3.9683 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1817 -0.4495 2.8016 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0532 0.6869 3.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8114 1.2181 1.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8576 1.6412 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4539 2.2165 -0.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4255 1.2808 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8746 1.7597 -2.3716 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 1.7277 -3.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0329 2.0916 -4.6989 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7569 1.8811 -5.5203 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6377 2.8265 -5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4041 2.2394 -5.7742 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4765 2.0253 -7.2558 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2168 1.1721 -7.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6007 1.6497 -8.3742 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.0032 -7.0636 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1528 -1.1646 -6.5669 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4108 -1.3026 -5.7030 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9290 0.0223 -5.2728 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3095 -0.0862 -4.9931 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 1.3861 -4.6189 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.9586 2.4056 -4.3797 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 1.8320 -5.9766 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1232 1.2406 -3.3296 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9106 0.0982 -3.5071 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8890 -0.0820 -2.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6956 -1.2704 -2.5721 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3863 -2.3869 -4.9267 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9963 -3.5446 -4.7021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0389 -3.7865 -5.4283 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5013 -4.4765 -3.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2076 -4.0904 -2.3285 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3479 -3.6366 -1.4822 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -2.4099 -1.9844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -1.2636 -1.3355 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6121 -1.0868 0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6603 0.0717 0.2134 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3267 1.3881 -0.1645 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5434 1.5884 -1.4823 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5696 1.3687 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1069 0.5937 1.9017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8205 0.2494 2.8057 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6053 0.3448 1.7342 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9349 1.6668 1.9899 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5648 2.6206 2.6361 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1253 3.9603 2.9915 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5593 4.3319 4.2855 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2822 4.3476 2.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3143 3.6333 3.6423 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0895 3.7498 5.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1822 3.0794 5.9344 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5411 3.7034 5.6855 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8092 -5.3214 9.6104 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3846 -6.9761 9.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8679 -6.6725 8.9688 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5329 -5.4874 8.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2077 -7.1849 7.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -5.7831 5.7861 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2554 -6.7456 6.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3456 -4.6882 7.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7379 -3.7589 6.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2144 -5.4076 5.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -4.3901 4.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1483 -2.3841 5.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9774 -3.4468 4.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2136 -3.4515 7.2967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2891 -4.1090 6.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6584 -1.1702 6.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1126 -2.0772 7.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7795 -0.6480 5.4516 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8706 -2.2488 4.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5906 -1.6277 3.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7527 -0.0694 4.2848 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7502 -1.2541 2.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3977 -0.1120 2.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8602 0.2703 3.8662 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5101 1.4960 3.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4223 0.3294 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4923 2.0107 2.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2308 0.7730 0.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1733 2.4259 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6709 2.5414 -1.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9741 3.1895 -0.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0175 0.2657 -1.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3263 1.2260 -0.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 2.7484 -2.3183 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6442 1.0330 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2953 0.6654 -3.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8463 2.3492 -2.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7717 1.3787 -5.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3734 3.1156 -4.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0373 2.0716 -6.5711 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4656 0.8203 -5.4603 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5426 3.0948 -4.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7819 3.8227 -5.7131 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2828 1.2047 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4832 2.8454 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3579 2.9708 -7.8057 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 1.5089 -7.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2239 -1.9650 -7.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7168 -1.5997 -5.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2278 -1.5738 -6.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4135 0.4769 -4.3971 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8412 0.7262 -6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2993 2.7682 -5.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4834 0.2060 -4.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2377 -0.7880 -3.5983 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4915 0.8375 -2.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2947 -0.2586 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6417 -1.1015 -2.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2953 -2.0929 -2.0738 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -4.9789 -4.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1993 -5.3957 -3.6329 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3721 -3.3219 -2.3244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7383 -5.0019 -1.8184 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0549 -3.6206 -0.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1073 -4.4989 -1.5104 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3613 -2.4520 -3.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5916 -0.4284 -1.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1077 -1.9598 0.4692 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4953 -0.9013 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6642 -0.0795 -0.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6813 2.1977 0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6596 1.6427 -1.9383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8756 2.3890 0.9324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3739 0.8609 0.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3356 -0.4715 2.3394 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0596 1.8224 1.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5985 2.3332 2.9608 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7167 4.6807 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2081 3.6612 4.6258 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3647 5.4400 3.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6258 4.3829 1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4525 2.5971 3.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 4.1812 3.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0473 4.8238 5.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1469 3.2344 5.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9184 3.1519 7.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2129 2.0102 5.6874 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4583 4.7885 5.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 3.2171 6.3732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8188 3.5697 4.6421 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 1 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 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 31 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 28 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 1 0 56 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 53 47 1 0 1 63 1 0 1 64 1 0 1 65 1 0 2 66 1 0 2 67 1 0 3 68 1 0 3 69 1 0 4 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 0 6 75 1 0 7 76 1 0 7 77 1 0 8 78 1 0 8 79 1 0 9 80 1 0 9 81 1 0 10 82 1 0 10 83 1 0 11 84 1 0 11 85 1 0 12 86 1 0 12 87 1 0 13 88 1 0 13 89 1 0 14 90 1 0 14 91 1 0 15 92 1 0 15 93 1 0 16 94 1 0 16 95 1 0 17 96 1 0 17 97 1 0 18 98 1 0 18 99 1 0 19100 1 0 19101 1 0 20102 1 0 20103 1 0 21104 1 0 21105 1 0 22106 1 0 22107 1 0 23108 1 0 23109 1 0 27110 1 0 27111 1 0 28112 1 6 29113 1 0 29114 1 0 33115 1 0 35116 1 0 35117 1 0 36118 1 0 36119 1 0 37120 1 0 37121 1 0 41122 1 0 41123 1 0 42124 1 0 42125 1 0 43126 1 0 43127 1 0 44128 1 0 45129 1 0 46130 1 0 46131 1 0 47132 1 6 48133 1 1 49134 1 0 50135 1 0 50136 1 0 53137 1 1 54138 1 0 55139 1 0 56140 1 6 57141 1 0 58142 1 0 58143 1 0 59144 1 0 59145 1 0 60146 1 0 60147 1 0 61148 1 0 61149 1 0 62150 1 0 62151 1 0 62152 1 0 M END