HMDB0267971 RDKit 3D PA(20:4(6Z,8E,10E,14Z)-2OH(5S,12R)/i-18:0) 125124 0 0 0 0 0 0 0 0999 V2000 13.9166 1.1342 -0.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1815 0.8918 1.1976 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1258 0.2109 2.1647 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6075 -1.1145 1.6169 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4473 -2.0725 1.3987 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9713 -3.3195 0.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5993 -3.8049 -0.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6102 -3.1019 -1.1667 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3733 -3.9749 -1.4016 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8381 -4.3254 -0.1453 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3749 -3.0253 -2.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2494 -2.7596 -1.4726 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2487 -1.8492 -2.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1094 -1.6012 -1.4033 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1533 -0.7196 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0273 -0.3633 -1.4606 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5688 -0.8015 -0.1664 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5555 -1.2388 0.7263 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7233 0.2532 0.5259 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3925 1.5267 0.8243 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8471 2.3468 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6888 2.7941 -1.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 3.3191 -2.2616 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3834 2.6403 -0.7395 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 3.0889 -1.5931 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 2.9235 -0.9872 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0154 3.6984 0.3595 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4052 5.0089 0.1297 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4004 5.8835 1.5826 P 0 0 0 0 0 5 0 0 0 0 0 0 1.7440 5.9040 2.2389 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1387 7.4578 1.2729 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7226 5.0979 2.6022 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4114 1.6252 -0.6696 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7219 1.2506 -1.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4242 2.1055 -1.6098 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2337 -0.0975 -0.7008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -0.0317 -0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2225 0.9102 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6678 1.0804 0.5373 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5825 0.0415 0.9594 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8507 -1.2038 0.2756 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3658 -1.2238 -1.0949 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5782 -0.5308 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8982 -0.7263 -0.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1543 -0.4194 0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5974 -0.6654 0.8804 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5092 0.2047 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9651 0.0440 0.4937 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3858 -1.3672 0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8413 -1.4904 0.7322 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3478 -2.9037 0.5785 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7548 -0.5699 -0.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0256 1.0384 0.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7552 2.1596 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6967 0.3425 -0.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9718 1.9031 1.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2226 0.3848 1.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6041 -0.0076 3.1183 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9461 0.9055 2.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0684 -0.9214 0.6309 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3466 -1.5738 2.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5851 -1.6172 0.9454 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1280 -2.3412 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7182 -3.8720 1.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0468 -4.7319 -0.6639 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3499 -2.0843 -0.8903 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1276 -2.9765 -2.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5712 -4.8332 -1.9895 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8204 -3.4514 0.3574 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6278 -2.5974 -2.9894 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0313 -3.2152 -0.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3926 -1.3643 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0071 -2.1003 -0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3601 -0.2882 -2.9994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3367 0.2993 -2.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -1.6806 -0.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0675 -1.7298 1.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2121 -0.2012 1.4097 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8791 0.4451 -0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7526 2.1555 1.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2930 1.2861 1.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6598 1.8885 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3157 3.2966 0.1139 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4215 2.5956 -2.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4938 4.1661 -1.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7659 3.4559 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7468 3.2149 1.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9839 3.6663 0.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8864 7.4216 0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5885 5.0517 2.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0174 -0.8107 -1.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9029 -0.4955 0.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0781 0.4396 -1.6509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1926 -1.0144 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7129 1.9078 0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7205 0.6516 1.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7969 1.9439 1.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0745 1.6519 -0.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2316 -0.2627 2.0254 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 0.5677 1.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 -1.8891 0.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5724 -1.8122 0.9134 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3727 -2.3118 -1.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5332 -0.8101 -1.7594 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3411 0.5895 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7027 -0.7159 -2.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2803 -1.7835 -1.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6351 -0.1176 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0213 0.6962 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5758 -0.9650 1.2747 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7887 -0.4716 1.9634 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8349 -1.7445 0.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1676 1.2626 0.2315 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5224 -0.0759 -1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5588 0.6598 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1661 0.4431 1.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8042 -2.1273 0.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3561 -1.6692 -0.7869 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9316 -1.1744 1.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1852 -3.0258 1.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7099 -3.1189 -0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5549 -3.6395 0.8363 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7328 -1.0849 -0.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9472 0.3774 0.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3890 -0.3007 -1.0272 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 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 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 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 2 57 1 0 3 58 1 0 3 59 1 0 4 60 1 0 4 61 1 0 5 62 1 0 5 63 1 0 6 64 1 0 7 65 1 0 8 66 1 0 8 67 1 0 9 68 1 6 10 69 1 0 11 70 1 0 12 71 1 0 13 72 1 0 14 73 1 0 15 74 1 0 16 75 1 0 17 76 1 6 18 77 1 0 19 78 1 0 19 79 1 0 20 80 1 0 20 81 1 0 21 82 1 0 21 83 1 0 25 84 1 0 25 85 1 0 26 86 1 6 27 87 1 0 27 88 1 0 31 89 1 0 32 90 1 0 36 91 1 0 36 92 1 0 37 93 1 0 37 94 1 0 38 95 1 0 38 96 1 0 39 97 1 0 39 98 1 0 40 99 1 0 40100 1 0 41101 1 0 41102 1 0 42103 1 0 42104 1 0 43105 1 0 43106 1 0 44107 1 0 44108 1 0 45109 1 0 45110 1 0 46111 1 0 46112 1 0 47113 1 0 47114 1 0 48115 1 0 48116 1 0 49117 1 0 49118 1 0 50119 1 0 51120 1 0 51121 1 0 51122 1 0 52123 1 0 52124 1 0 52125 1 0 M END