HMDB0289347 RDKit 3D PC(DiMe(9,5)/PGD2) 144145 0 0 0 0 0 0 0 0999 V2000 5.1832 4.6326 0.5956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4083 5.8294 1.0848 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9164 5.5132 1.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 6.8006 1.7346 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7985 6.6579 1.9376 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5527 5.5879 2.9453 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 4.3647 2.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 3.6652 3.8107 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4298 2.2682 4.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 1.3268 4.2644 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2615 -0.0527 4.5256 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3316 -1.0922 4.7351 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1488 -1.2171 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2387 -2.1820 3.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1044 -3.6250 3.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4356 -4.4267 2.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0073 -4.2014 2.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2603 -3.5800 3.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3221 -4.7077 1.2148 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0534 -4.4481 1.1465 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7044 -4.9655 -0.1291 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6603 -6.4581 -0.2582 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3461 -6.9242 -0.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2247 -8.5884 -0.5035 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.4252 -9.2250 -1.1429 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0478 -9.3572 0.9959 O 0 0 0 0 0 1 0 0 0 0 0 0 1.1959 -8.8721 -1.4242 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9442 -8.6201 -2.7714 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1453 -8.8154 -3.6307 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2501 -7.9489 -3.2663 N 0 0 0 0 0 4 0 0 0 0 0 0 3.7516 -8.3138 -1.9385 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3493 -8.2710 -4.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9657 -6.5555 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -4.3091 -1.2407 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7088 -3.3369 -1.9867 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8768 -2.9870 -1.6857 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -2.7169 -3.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7606 -1.5126 -3.5626 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1223 -0.8011 -4.7646 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9596 0.3809 -5.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5421 1.6136 -4.9911 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1612 1.9769 -4.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 2.8237 -3.4682 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4179 3.1737 -3.2564 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1942 2.9191 -4.4097 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5019 4.6020 -2.8406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3256 5.2019 -3.5336 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1941 6.3082 -3.9875 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7348 4.1363 -3.5764 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5870 4.2300 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8938 4.3338 -2.3296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6676 4.4200 -1.0402 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8864 5.0130 -1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8094 3.0524 -0.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5338 2.9843 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9406 3.4737 0.8436 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4651 3.2714 2.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8745 3.7319 2.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4012 4.5242 4.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4605 4.2401 6.2989 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7448 5.7368 4.3024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2164 6.9387 5.0596 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4932 3.8882 0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7439 4.1639 1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9093 5.0102 -0.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7403 6.1515 2.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 6.7058 0.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4977 5.2136 0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8043 4.7415 2.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4622 7.6369 1.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8182 7.0975 2.6571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3175 7.6033 2.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3245 6.3201 0.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 2.2319 4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9581 1.8989 3.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2389 1.7041 5.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5149 1.4444 3.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3799 -0.3597 3.6626 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4148 -0.0740 5.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9481 -0.6942 5.5965 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8624 -2.0029 5.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6455 -0.1873 3.3767 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4564 -1.2318 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9339 -1.8863 4.3483 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9464 -1.8714 2.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1743 -4.0466 3.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7263 -3.8900 4.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5234 -5.5490 2.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9795 -4.3972 1.5295 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -3.3450 1.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6187 -4.8285 2.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7513 -4.6151 -0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0346 -6.8747 0.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3303 -6.8501 -1.0321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4635 -7.6351 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2006 -9.4110 -3.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8494 -8.5518 -4.6746 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4958 -9.8599 -3.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8592 -8.2071 -1.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5328 -9.3991 -1.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2341 -7.7777 -1.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9045 -8.3499 -5.1853 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9156 -9.1487 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0095 -7.3612 -4.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8974 -6.4547 -3.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5664 -6.1236 -4.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0927 -5.9965 -2.4328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.3754 -2.8281 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8315 -3.4454 -3.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9412 -0.8217 -2.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7685 -1.8323 -3.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2796 -1.4937 -5.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0898 -0.6346 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 0.1847 -5.2292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2623 2.4008 -5.1874 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5889 1.1924 -4.7324 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1559 2.6810 -5.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3902 2.2202 -2.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8262 2.5352 -2.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4636 1.9501 -4.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4379 5.0931 -3.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2847 4.6777 -1.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3079 4.2617 -4.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0716 4.2099 -1.3692 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4295 4.3571 -3.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1516 5.0679 -0.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7052 5.7873 -1.9749 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3126 2.3759 -1.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7849 2.6198 -0.3649 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9376 3.4637 1.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5591 1.8943 1.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6153 2.9016 0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0596 4.5382 0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 2.1682 2.5131 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7632 3.7162 3.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3376 3.7506 1.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4739 3.0663 3.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8727 4.7883 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5044 3.9692 6.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1889 5.1231 6.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1971 3.4068 6.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1006 6.7089 5.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3426 7.8043 4.3897 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3789 7.2414 5.7614 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 2 0 17 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 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 21 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 50 51 2 0 51 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 8 59 2 0 59 60 1 0 59 61 1 0 61 62 1 0 61 6 2 0 49 43 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 9 74 1 0 9 75 1 0 10 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 20 90 1 0 20 91 1 0 21 92 1 1 22 93 1 0 22 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 29 98 1 0 31 99 1 0 31100 1 0 31101 1 0 32102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 33107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 41115 1 0 42116 1 0 42117 1 0 43118 1 1 44119 1 1 45120 1 0 46121 1 0 46122 1 0 49123 1 6 50124 1 0 51125 1 0 52126 1 1 53127 1 0 54128 1 0 54129 1 0 55130 1 0 55131 1 0 56132 1 0 56133 1 0 57134 1 0 57135 1 0 58136 1 0 58137 1 0 58138 1 0 60139 1 0 60140 1 0 60141 1 0 62142 1 0 62143 1 0 62144 1 0 M CHG 2 26 -1 30 1 M END