HMDB0289573 RDKit 3D PC(P-18:0/5-iso PGF2VI) 138138 0 0 0 0 0 0 0 0999 V2000 6.2730 3.8292 -0.9625 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2348 5.3235 -0.9745 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1327 5.9296 0.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 5.4121 1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7661 6.0553 2.4034 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5553 5.6671 3.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2837 6.0239 2.4826 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 5.7181 3.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1483 6.1078 2.4871 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4438 5.9763 3.1805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 4.6480 3.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1308 3.6423 2.5427 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6433 2.3385 3.1408 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 1.3135 2.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8761 0.8747 1.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7285 0.2059 1.9574 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2752 -0.2009 0.9287 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5584 -1.4705 0.6959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4573 -1.8040 -0.2376 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2143 -2.9310 -0.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0596 -2.7446 -1.7169 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7577 -1.4082 -1.4727 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6749 -1.5065 -0.4494 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 -0.0040 -0.1849 P 0 0 0 0 0 5 0 0 0 0 0 0 4.3879 1.0292 -0.6577 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7795 0.2314 -1.1352 O 0 0 0 0 0 1 0 0 0 0 0 0 5.7118 0.3125 1.4281 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7199 -0.8219 2.2277 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9948 -0.4116 3.6495 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0279 -1.5362 4.5469 N 0 0 0 0 0 4 0 0 0 0 0 0 7.0714 -2.4799 4.1872 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1708 -1.1116 5.9268 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7516 -2.2152 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0945 -2.5685 -2.7125 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8382 -3.1430 -3.8911 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5572 -4.0666 -4.3047 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6457 -2.6335 -4.7082 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0451 -1.4878 -3.9704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1715 -1.4424 -3.5393 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1558 -2.4862 -3.6983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6998 -3.0924 -2.4231 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5904 -3.7604 -1.6682 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0123 -4.0594 -0.3772 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3672 -4.9970 -2.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6608 -5.2663 -3.2699 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0429 -6.5699 -2.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -4.2768 -2.6804 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7871 -3.9302 -3.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0236 -4.0565 -3.0606 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1441 -3.6156 -4.0242 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6177 -2.7949 -4.9823 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0536 -2.7797 -3.1173 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2308 -1.6392 -2.5706 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0296 -0.7654 -1.6493 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2105 -0.1024 -2.3009 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7742 0.8086 -3.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1152 3.4510 -1.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4679 3.4916 0.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3522 3.4309 -1.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1155 5.7355 -1.5354 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3359 5.6632 -1.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 5.6098 0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 7.0244 0.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9799 4.3264 1.1961 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 5.6849 0.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7877 7.1767 2.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 5.8161 2.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6203 6.1614 4.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5384 4.5854 3.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2981 7.1102 2.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2374 5.4300 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0525 4.6706 3.6346 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0609 6.3487 4.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0858 5.4967 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 7.1523 2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2608 6.3839 2.5102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4115 6.6430 4.0957 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2821 4.2266 4.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9109 4.8007 4.1139 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8973 4.0877 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2551 3.4342 1.9084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6415 2.6159 3.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 2.0096 3.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8216 1.7203 1.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4287 0.4359 2.6382 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4982 1.7552 0.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2882 0.1738 0.4582 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2971 0.9391 2.6587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0873 -0.6770 2.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7635 0.5712 0.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0318 -2.2160 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -3.8301 -0.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9189 -3.0997 0.4287 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7976 -3.5097 -1.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9956 -0.5998 -1.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3129 -1.0898 -2.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5558 -1.4563 1.8601 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7892 -1.4057 2.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9551 0.1343 3.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2019 0.2778 4.0146 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7622 -2.9492 3.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0601 -2.0008 4.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0535 -3.3021 4.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8171 -0.0436 6.0248 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5066 -1.7089 6.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2140 -1.1409 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6609 -2.8768 5.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9463 -1.4493 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7275 -2.8441 3.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1047 -2.2199 -5.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0019 -3.4435 -4.9702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.6214 -3.7838 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5194 -0.5072 -2.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0727 -1.9834 -4.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9108 -3.2797 -4.4015 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2241 -2.3196 -1.8028 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6703 -3.1531 -1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3436 -4.7223 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1281 -5.8247 -1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4993 -4.8975 -3.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5601 -5.1672 -4.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4225 -7.1826 -3.3757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8452 -4.6704 -1.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6361 -3.5041 -4.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -4.4526 -2.1111 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6787 -4.4982 -4.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3452 -3.4021 -5.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3170 -3.4345 -2.2553 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9560 -2.4978 -3.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7967 -1.0116 -3.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -2.1034 -2.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3612 0.0360 -1.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4237 -1.3418 -0.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7134 0.5185 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8861 -0.8524 -2.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0826 1.5996 -3.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2898 0.1771 -4.2042 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6821 1.3367 -3.8097 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 3 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 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 2 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 47 41 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 6 69 1 0 7 70 1 0 7 71 1 0 8 72 1 0 8 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 17 90 1 0 18 91 1 0 20 92 1 0 20 93 1 0 21 94 1 6 22 95 1 0 22 96 1 0 28 97 1 0 28 98 1 0 29 99 1 0 29100 1 0 31101 1 0 31102 1 0 31103 1 0 32104 1 0 32105 1 0 32106 1 0 33107 1 0 33108 1 0 33109 1 0 37110 1 0 37111 1 0 38112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 1 42117 1 1 43118 1 0 44119 1 0 44120 1 0 45121 1 6 46122 1 0 47123 1 1 48124 1 0 49125 1 0 50126 1 6 51127 1 0 52128 1 0 52129 1 0 53130 1 0 53131 1 0 54132 1 0 54133 1 0 55134 1 0 55135 1 0 56136 1 0 56137 1 0 56138 1 0 M CHG 2 26 -1 30 1 M END