HMDB0298530 RDKit 3D DG(20:4(6E,8Z,11Z,14Z)-OH(5S)/i-13:0/0:0) 104103 0 0 0 0 0 0 0 0999 V2000 -14.5694 -0.7745 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2699 -0.9059 -2.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1119 -0.9995 -1.0983 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3362 -2.2176 -0.2498 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2305 -2.4056 0.7802 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9573 -2.5481 0.0833 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9194 -1.7639 0.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 -0.5785 1.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 0.6187 0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8108 1.4952 0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7633 1.5855 1.4107 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5795 0.6908 2.5035 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5124 -0.0667 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3683 -0.1024 1.8022 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3422 -0.8945 2.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1455 -0.9518 1.1818 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4745 -1.5610 -0.0062 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6449 0.4490 0.8747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2605 1.1867 2.1315 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8175 2.5730 1.7544 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3674 2.6368 0.8809 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4664 2.9038 1.4275 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3308 2.4287 -0.4623 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3335 2.4713 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 1.4690 -1.2054 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9181 0.0874 -1.5127 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3051 0.0546 -2.7676 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0427 1.5911 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3817 2.0203 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 2.2846 -0.9426 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9325 2.1067 1.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3543 2.4591 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3909 1.5375 1.0626 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3988 1.0928 -0.3384 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 0.1828 -0.4277 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 -0.2537 -1.8208 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8160 -1.1327 -2.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2193 -0.7158 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9261 -0.6178 -1.0333 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2044 -1.8534 -0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0947 -2.7133 0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2254 -2.7444 -1.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3389 -0.2793 -1.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3761 -0.0813 -0.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9455 -1.7118 -0.9064 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2926 -1.8225 -2.7278 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1437 -0.0335 -2.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1750 -1.1264 -1.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1267 -0.0859 -0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3337 -2.2074 0.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3239 -3.1202 -0.9049 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3038 -1.7751 1.6441 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4531 -3.4605 1.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8874 -3.4184 -0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0268 -1.9797 -0.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0340 -0.4766 1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3723 -0.7218 1.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4589 0.7866 -0.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8048 2.3340 -0.3278 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7436 2.7005 1.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 1.6210 0.8151 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3394 0.6353 3.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4944 -0.7213 3.5801 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2976 0.4846 0.9138 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3741 -1.5116 2.9598 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3525 -1.4951 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -1.3481 -0.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4277 0.9673 0.3127 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7529 0.3265 0.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0252 1.1790 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3524 0.6941 2.5843 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6277 3.1917 2.6855 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6783 3.1149 1.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7384 3.5191 -1.4742 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8667 2.2690 -2.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1687 1.7097 -2.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3018 -0.3538 -0.7239 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8262 -0.5693 -1.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3991 -0.8427 -3.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7117 1.1599 2.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 2.8757 2.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5446 3.4880 1.0977 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5918 2.6639 2.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4436 0.6231 1.7433 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3911 2.0360 1.2796 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5705 1.8781 -1.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6305 0.3581 -0.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5586 -0.5918 0.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4725 0.9347 -0.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7726 0.6981 -2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7462 -0.7036 -2.1086 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5143 -1.3037 -3.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6944 -2.1648 -1.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8100 -1.3310 -3.0755 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2655 0.3212 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4792 0.1123 -0.3522 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9639 -0.1185 -1.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8147 -1.5244 0.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9125 -3.5683 -0.5089 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1548 -2.1847 0.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3930 -3.2040 1.1878 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3707 -3.6264 -0.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8226 -3.1002 -1.9701 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1534 -2.1345 -1.1012 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 39 40 1 0 40 41 1 0 40 42 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 0 2 47 1 0 3 48 1 0 3 49 1 0 4 50 1 0 4 51 1 0 5 52 1 0 5 53 1 0 6 54 1 0 7 55 1 0 8 56 1 0 8 57 1 0 9 58 1 0 10 59 1 0 11 60 1 0 11 61 1 0 12 62 1 0 13 63 1 0 14 64 1 0 15 65 1 0 16 66 1 1 17 67 1 0 18 68 1 0 18 69 1 0 19 70 1 0 19 71 1 0 20 72 1 0 20 73 1 0 24 74 1 0 24 75 1 0 25 76 1 6 26 77 1 0 26 78 1 0 27 79 1 0 31 80 1 0 31 81 1 0 32 82 1 0 32 83 1 0 33 84 1 0 33 85 1 0 34 86 1 0 34 87 1 0 35 88 1 0 35 89 1 0 36 90 1 0 36 91 1 0 37 92 1 0 37 93 1 0 38 94 1 0 38 95 1 0 39 96 1 0 39 97 1 0 40 98 1 0 41 99 1 0 41100 1 0 41101 1 0 42102 1 0 42103 1 0 42104 1 0 M END