HMDB0261784 RDKit 3D PE(18:4(6Z,9Z,12Z,15Z)/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) 124123 0 0 0 0 0 0 0 0999 V2000 4.3370 5.0612 -3.7951 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0857 3.8085 -3.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 2.6813 -4.0276 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9464 1.6336 -3.5095 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7768 1.5116 -2.0441 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4548 0.2746 -1.6153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8179 -0.6938 -1.0253 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3648 -0.5988 -0.7592 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1341 -0.6097 0.6904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3973 -1.4593 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6409 -2.5856 0.6878 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1007 -3.8617 1.2566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3467 -4.6901 1.9353 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0743 -4.3833 2.1798 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8953 -5.5898 1.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3586 -5.3403 1.8886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9545 -4.2156 1.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9924 -4.4607 -0.3275 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1121 -4.8753 -0.7914 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9604 -4.2985 -1.2309 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2778 -4.6268 -2.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1637 -4.5199 -3.5563 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1152 -5.5695 -3.3155 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3889 -5.4280 -2.1632 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7079 -6.7401 -2.1329 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.0400 -7.9317 -2.7424 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0578 -6.4778 -3.0747 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 -7.0935 -0.5306 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9945 -8.4602 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3031 -8.6361 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5987 -8.1318 1.5832 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6679 -3.2101 -3.6508 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8014 -2.4833 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3983 -3.1122 -5.7833 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3344 -1.1268 -5.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3709 -0.0653 -4.7947 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8415 1.3008 -5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.6336 -4.3148 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1800 2.9485 -4.6547 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7604 1.6642 -2.8181 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1868 0.4429 -2.3745 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5023 2.8271 -2.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5062 3.0927 -1.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7827 2.2353 -0.1499 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7584 2.4632 1.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4508 3.5744 1.7064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 3.7580 3.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0735 4.8721 3.6684 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0257 5.0658 4.9709 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7255 6.2120 5.6245 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9737 5.8498 6.0741 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8623 6.6064 6.8295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3981 7.7341 7.5787 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7744 8.8698 7.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4415 9.1448 7.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5588 9.4505 8.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 5.4994 -4.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3377 5.8509 -3.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2958 4.8343 -4.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1648 3.9264 -3.6142 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0241 3.8428 -2.2193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6502 2.7356 -5.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5851 0.8699 -4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7181 1.5732 -1.7896 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3356 2.3270 -1.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5309 0.2172 -1.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3512 -1.5934 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 0.2337 -1.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9698 -1.5763 -1.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6377 0.1776 1.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2928 -1.3791 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7867 -2.5721 -0.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4254 -2.3294 0.8846 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1564 -4.1249 1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7789 -5.6454 2.3386 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4745 -3.5294 1.6631 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2857 -4.3224 3.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6406 -5.6825 0.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -6.5020 2.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5664 -5.2330 2.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9016 -6.2782 1.5813 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9919 -4.0262 1.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -3.2710 1.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1461 -3.9664 -2.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7254 -5.6679 -2.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6312 -4.8351 -4.5557 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6625 -6.5493 -3.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4026 -5.6396 -4.1753 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9044 -6.6906 -2.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0304 -8.9278 -0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7764 -9.0187 -0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1636 -9.7016 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5522 -8.0545 1.8312 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1835 -8.8603 2.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5406 -7.2914 2.2134 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3602 -0.9484 -4.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.0367 -6.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2561 -0.1998 -5.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8215 -0.1333 -3.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 1.2822 -6.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6299 2.0834 -5.0567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2321 0.9731 -4.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6344 3.1802 -4.1685 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2932 1.7864 -2.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4291 -0.1858 -2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0359 3.4474 -3.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0626 3.9577 -0.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2245 1.3676 -0.5017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1977 1.7959 1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0355 4.2982 1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8293 3.0853 3.6739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6362 5.5660 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4652 4.3646 5.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8358 7.0900 4.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 5.5384 5.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8162 6.6553 6.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9306 5.6996 7.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4033 7.6670 8.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 9.6910 8.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0598 8.3800 6.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5208 10.1084 6.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1791 10.3216 8.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0124 9.6699 9.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2599 8.5807 8.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 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 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 25 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 22 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 2 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 2 0 54 55 1 0 55 56 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 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 7 67 1 0 8 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 72 1 0 11 73 1 0 12 74 1 0 13 75 1 0 14 76 1 0 14 77 1 0 15 78 1 0 15 79 1 0 16 80 1 0 16 81 1 0 17 82 1 0 17 83 1 0 21 84 1 0 21 85 1 0 22 86 1 6 23 87 1 0 23 88 1 0 27 89 1 0 29 90 1 0 29 91 1 0 30 92 1 0 30 93 1 0 31 94 1 0 31 95 1 0 35 96 1 0 35 97 1 0 36 98 1 0 36 99 1 0 37100 1 0 37101 1 0 38102 1 1 39103 1 0 40104 1 1 41105 1 0 42106 1 0 43107 1 0 44108 1 0 45109 1 0 46110 1 0 47111 1 0 48112 1 0 49113 1 0 50114 1 6 51115 1 0 52116 1 0 52117 1 0 53118 1 0 54119 1 0 55120 1 0 55121 1 0 56122 1 0 56123 1 0 56124 1 0 M END