HMDB0295058 RDKit 3D DG(20:4(5Z,8Z,11Z,14Z)-OH(16R)/14:0/0:0) 107106 0 0 0 0 0 0 0 0999 V2000 -15.4268 -0.5466 2.2049 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2278 0.9412 1.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9071 1.4296 2.3947 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7248 0.6671 1.7557 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7344 0.8337 0.2903 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7481 0.0753 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3042 0.1838 -0.3047 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7718 -0.3086 0.9803 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2417 -0.1952 1.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5583 -0.9947 0.0501 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0482 -0.8960 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5217 0.4957 0.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0233 0.5878 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -0.1768 -0.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0423 -0.6890 -1.7994 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9757 -0.3787 -0.8869 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3988 -1.1049 -1.9176 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5222 -0.2277 -2.8235 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2925 0.7839 -3.4049 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7227 -2.3753 -1.5574 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3446 -2.3872 -0.7143 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3666 -1.9410 0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -1.4573 1.0658 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5772 -2.0057 1.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5286 -0.8447 1.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9861 -0.8429 -0.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9249 0.2339 -0.5705 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1285 0.0113 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6456 -1.3557 -1.2518 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9446 -1.5265 -2.6823 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0699 -1.8312 -3.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3284 -2.0787 -2.4966 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3717 -1.1394 -2.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9900 -0.3236 -2.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7329 -0.2056 -0.6779 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2942 1.1480 -0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8858 1.9728 0.4378 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0840 1.8718 1.2106 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7645 2.2639 2.5734 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9535 0.6959 1.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1467 1.0079 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9820 2.1247 1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5360 1.7871 0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1810 -0.6647 3.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4809 -0.7774 1.9696 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7340 -1.1886 1.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4647 1.1871 0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0054 1.4574 2.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8544 1.2405 3.4753 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8342 2.5046 2.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7026 -0.3261 2.1529 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8559 1.2649 2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5818 1.9292 0.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7731 0.6561 -0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0090 0.2557 -1.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0760 -1.0428 -0.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7295 -0.2318 -1.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0454 1.3007 -0.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9570 -1.4187 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1413 0.1590 1.8785 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9962 -0.5518 2.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 0.8931 1.0706 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7906 -2.0755 0.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8675 -0.8286 -0.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8310 -1.3277 1.2172 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6302 -1.6276 -0.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7299 0.8161 -0.9825 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0474 1.2263 0.7126 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7071 0.2408 1.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7664 1.6685 0.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 -1.4094 -2.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0982 -0.8230 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3353 0.1987 -2.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 1.6679 -3.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4874 -3.0994 -1.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5102 -2.8948 -2.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2895 -1.9478 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1406 -2.9423 1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4112 -0.9583 1.8569 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0419 0.1129 1.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3089 -1.8274 -0.5303 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0582 -0.6556 -0.9026 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6494 1.3066 -0.4377 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8166 0.8480 -1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6419 -1.3544 -0.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1031 -2.1773 -0.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0898 -1.3737 -3.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 -1.9231 -4.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1421 -2.2319 -1.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7367 -3.1203 -2.8333 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6226 -1.1644 -4.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7517 0.3393 -2.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6507 -0.4837 -0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9270 -0.9579 -0.4437 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3374 1.4719 -0.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3426 3.0105 0.5497 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7702 2.7820 0.9312 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 3.1160 2.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5100 -0.1970 1.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5198 0.4265 0.3921 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7641 0.0823 2.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7778 1.1739 3.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8668 2.2045 2.4973 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5148 3.1147 1.7371 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6984 0.7029 0.2886 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5202 2.2844 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8877 2.1843 -0.3944 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 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 17 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 2 0 28 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 1 44 1 0 1 45 1 0 1 46 1 0 2 47 1 0 2 48 1 0 3 49 1 0 3 50 1 0 4 51 1 0 4 52 1 0 5 53 1 0 5 54 1 0 6 55 1 0 6 56 1 0 7 57 1 0 7 58 1 0 8 59 1 0 8 60 1 0 9 61 1 0 9 62 1 0 10 63 1 0 10 64 1 0 11 65 1 0 11 66 1 0 12 67 1 0 12 68 1 0 13 69 1 0 13 70 1 0 17 71 1 6 18 72 1 0 18 73 1 0 19 74 1 0 20 75 1 0 20 76 1 0 24 77 1 0 24 78 1 0 25 79 1 0 25 80 1 0 26 81 1 0 26 82 1 0 27 83 1 0 28 84 1 0 29 85 1 0 29 86 1 0 30 87 1 0 31 88 1 0 32 89 1 0 32 90 1 0 33 91 1 0 34 92 1 0 35 93 1 0 35 94 1 0 36 95 1 0 37 96 1 0 38 97 1 6 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 43107 1 0 M END