HMDB0287378 RDKit 3D PC(PGF2alpha/20:3(8Z,11Z,14Z)) 145145 0 0 0 0 0 0 0 0999 V2000 -10.1444 0.5497 -0.8051 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8432 0.2174 -1.4605 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7659 1.2500 -1.2328 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5244 0.8025 -1.9369 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3639 1.7937 -1.7771 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2263 1.2170 -2.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 0.9219 -1.9547 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8319 1.1415 -0.5109 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5182 -0.2023 0.0579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3988 -0.4886 0.6477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2961 0.4684 0.8343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9443 0.0426 0.1713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 -0.1041 0.8376 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2239 0.1264 2.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5447 -0.9562 3.1603 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6858 -1.8246 3.0973 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8379 -2.9424 2.1816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7909 -2.8598 0.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1051 -4.2627 0.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0479 -4.2743 -1.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4598 -5.3372 -1.8947 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5889 -3.2510 -2.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6048 -3.4562 -3.5449 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3473 -2.4557 -4.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9008 -1.1664 -4.3992 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7117 -0.2666 -3.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9824 -0.6761 -2.2177 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2097 1.1019 -3.6874 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9543 1.9894 -2.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1556 2.2364 -1.6934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9251 3.1703 -0.5655 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7375 3.7659 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5698 4.6905 0.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5296 4.3220 1.8461 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5873 5.4549 2.9016 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9023 5.8725 3.0873 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8359 6.5886 2.2649 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0257 6.0619 1.1719 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2569 6.5784 -0.0925 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1652 4.5556 1.2438 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9580 4.0244 2.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9518 3.3646 3.1383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1922 2.8930 3.8095 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2649 3.1993 2.9442 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2344 1.4257 4.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5303 1.0059 4.7694 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5048 -0.4988 5.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7374 -0.9833 5.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6793 -2.4874 5.9183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1383 -3.5581 -4.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5187 -4.6224 -3.3419 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0816 -4.7363 -3.8167 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.3765 -6.1106 -4.4219 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4582 -3.5096 -4.9326 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.0358 -4.5375 -2.4092 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0186 -5.7027 -1.6578 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8432 -5.5412 -0.4175 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8588 -6.7277 0.4047 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.5104 -6.9828 0.8655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4385 -7.8648 -0.2563 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -6.4812 1.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7047 1.3705 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7720 -0.3834 -0.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0609 0.7592 0.2796 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5516 -0.8004 -1.2004 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0355 0.2272 -2.5712 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5609 1.4302 -0.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1415 2.2096 -1.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2002 -0.2086 -1.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 0.7935 -3.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2365 2.0357 -0.7457 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6592 2.7708 -2.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3485 1.0248 -3.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 0.4943 -2.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6287 1.6281 0.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 1.7482 -0.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2585 -1.0224 -0.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2274 -1.5049 1.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5393 1.5019 0.6534 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1414 0.4431 1.9831 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8813 -0.1511 -0.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9625 -0.3700 0.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4735 0.8513 2.6917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1731 0.8557 2.3183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3767 -0.5698 4.2559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5886 -1.6509 3.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9205 -2.2010 4.1939 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6126 -1.1029 2.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7866 -3.5387 2.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0244 -3.7525 2.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5081 -2.1524 0.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 -2.6832 0.3474 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3866 -4.9485 0.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -4.5251 0.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0396 -4.4534 -3.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4511 -2.4678 -4.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4045 -2.8228 -5.4304 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3198 1.0329 -4.3761 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0064 1.5441 -4.3631 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5851 2.9795 -2.9511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0712 1.6355 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9628 2.5974 -2.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5377 1.3004 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7151 3.4316 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9163 3.5367 -0.9726 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5356 4.8790 1.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3351 5.6928 0.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6863 3.3439 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 5.1536 3.8669 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9553 6.8743 3.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5452 7.3292 1.7963 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2881 7.1716 3.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 6.3245 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 6.8308 -0.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1784 4.1035 0.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9552 4.2171 1.5783 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0135 3.1482 3.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2892 3.4961 4.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3549 2.4316 2.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4086 1.1454 4.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1204 0.8331 3.1271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4089 1.3091 4.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5334 1.4902 5.7538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2762 -1.0705 4.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6467 -0.6959 5.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8607 -0.5247 6.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6643 -0.7868 5.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1144 -2.6844 6.8715 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1308 -2.9943 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6665 -2.9512 5.9948 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1523 -3.6936 -5.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6224 -2.6234 -3.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5069 -6.4919 -2.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0389 -5.9719 -1.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8445 -5.1999 -0.6919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3632 -4.7178 0.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5285 -7.5171 1.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0323 -5.9861 1.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -7.5342 0.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7357 -8.3671 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3424 -7.6039 -0.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7593 -8.5753 0.5575 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4253 -7.2608 2.3736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2802 -5.5189 2.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7309 -6.4766 1.3704 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 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 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 23 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 58 60 1 0 58 61 1 0 40 34 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 3 68 1 0 4 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 7 74 1 0 8 75 1 0 8 76 1 0 9 77 1 0 10 78 1 0 11 79 1 0 11 80 1 0 12 81 1 0 13 82 1 0 14 83 1 0 14 84 1 0 15 85 1 0 15 86 1 0 16 87 1 0 16 88 1 0 17 89 1 0 17 90 1 0 18 91 1 0 18 92 1 0 19 93 1 0 19 94 1 0 23 95 1 1 24 96 1 0 24 97 1 0 28 98 1 0 28 99 1 0 29100 1 0 29101 1 0 30102 1 0 30103 1 0 31104 1 0 32105 1 0 33106 1 0 33107 1 0 34108 1 1 35109 1 1 36110 1 0 37111 1 0 37112 1 0 38113 1 1 39114 1 0 40115 1 6 41116 1 0 42117 1 0 43118 1 1 44119 1 0 45120 1 0 45121 1 0 46122 1 0 46123 1 0 47124 1 0 47125 1 0 48126 1 0 48127 1 0 49128 1 0 49129 1 0 49130 1 0 50131 1 0 50132 1 0 56133 1 0 56134 1 0 57135 1 0 57136 1 0 59137 1 0 59138 1 0 59139 1 0 60140 1 0 60141 1 0 60142 1 0 61143 1 0 61144 1 0 61145 1 0 M CHG 2 54 -1 58 1 M END