HMDB0294418 RDKit 3D DG(20:4(6E,8Z,11Z,14Z)-OH(5S)/10:0/0:0) 95 94 0 0 0 0 0 0 0 0999 V2000 8.3052 3.0717 2.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3032 4.1137 2.6118 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4537 4.3710 1.7468 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3977 4.9071 0.3958 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 4.2851 -0.7827 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3707 4.0518 -0.7487 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8198 2.8812 -0.9324 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6522 1.6736 -1.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2375 1.1849 -2.5258 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7977 0.0176 -2.7788 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5794 -1.1262 -1.9453 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8934 -1.2189 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0009 -1.4195 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5772 -1.5793 0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7676 -1.7795 1.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2828 -1.9460 1.0236 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8235 -3.1369 1.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6318 -0.8155 1.7844 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1375 -0.8394 1.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.7249 0.2697 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8519 -0.7619 0.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.8538 1.3526 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5773 -0.7000 -0.8913 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9714 -0.7332 -1.0349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4752 -2.0571 -0.4924 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8193 -3.2189 -1.1572 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2697 -4.3898 -0.5533 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -2.1575 -0.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6914 -2.1878 0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1124 -2.1148 1.6144 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1871 -2.3006 0.4392 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5476 -2.6758 -0.9747 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0368 -2.8214 -1.1667 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6945 -1.5021 -0.8639 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1987 -1.5714 -1.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7676 -0.2154 -0.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4771 0.2845 0.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0950 1.6621 0.8575 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5962 1.5232 0.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7042 2.2598 1.6407 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3593 3.4502 1.8192 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0006 2.5588 3.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6768 5.0684 2.7701 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7195 3.8818 3.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2998 4.8826 2.3448 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9607 3.3197 1.6245 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9320 5.9825 0.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4692 5.2725 0.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9491 5.0705 -1.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4389 3.4177 -1.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 4.9478 -0.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7464 2.7263 -0.9055 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3043 0.9822 -0.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7135 1.7574 -1.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3234 1.9215 -3.3809 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5227 -0.1522 -3.8893 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0869 -2.0146 -2.5205 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4861 -1.4548 -2.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9732 -1.1465 -0.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 -1.4658 1.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1289 -1.5377 -0.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1936 -1.8194 2.1947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0228 -1.9122 -0.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5085 -3.5558 2.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 0.1883 1.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9191 -0.8314 2.8617 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -1.8317 2.1081 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6823 -0.0830 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0767 -1.4910 -0.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9271 0.3061 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4791 0.0681 -0.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2223 -0.7005 -2.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2251 -2.0554 0.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1296 -3.2634 -2.2256 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7289 -3.2207 -1.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5566 -5.0750 -0.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -1.2941 0.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4512 -3.0904 1.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0173 -3.6408 -1.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1128 -1.9323 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3892 -3.5772 -0.4229 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2253 -3.1731 -2.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5199 -1.3062 0.2174 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3159 -0.7247 -1.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4189 -1.7988 -2.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5858 -2.3591 -0.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8702 -0.2136 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2864 0.4997 -1.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3949 0.4143 0.8465 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8793 -0.3766 1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8338 2.0450 1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6670 2.3567 0.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8569 1.4961 -0.4173 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9780 0.6032 1.1315 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0551 2.4408 1.1077 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 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 1 40 1 0 1 41 1 0 1 42 1 0 2 43 1 0 2 44 1 0 3 45 1 0 3 46 1 0 4 47 1 0 4 48 1 0 5 49 1 0 5 50 1 0 6 51 1 0 7 52 1 0 8 53 1 0 8 54 1 0 9 55 1 0 10 56 1 0 11 57 1 0 11 58 1 0 12 59 1 0 13 60 1 0 14 61 1 0 15 62 1 0 16 63 1 6 17 64 1 0 18 65 1 0 18 66 1 0 19 67 1 0 19 68 1 0 20 69 1 0 20 70 1 0 24 71 1 0 24 72 1 0 25 73 1 1 26 74 1 0 26 75 1 0 27 76 1 0 31 77 1 0 31 78 1 0 32 79 1 0 32 80 1 0 33 81 1 0 33 82 1 0 34 83 1 0 34 84 1 0 35 85 1 0 35 86 1 0 36 87 1 0 36 88 1 0 37 89 1 0 37 90 1 0 38 91 1 0 38 92 1 0 39 93 1 0 39 94 1 0 39 95 1 0 M END