HMDB0284526 RDKit 3D PE(24:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)) 153152 0 0 0 0 0 0 0 0999 V2000 -6.7119 0.3486 -4.4353 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0826 0.7662 -3.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9656 0.3733 -2.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0741 -0.4710 -1.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3123 -1.1481 -0.7179 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7668 -0.8846 0.6807 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.9596 0.4861 0.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9498 -1.4275 1.7584 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9131 -2.2319 1.5738 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1035 -2.7711 2.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0553 -3.5493 2.4625 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6452 -3.9102 1.1235 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5815 -4.7016 0.9115 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -4.9999 -0.5108 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3413 -6.3346 -0.8164 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -4.4797 -0.6921 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3604 -4.6535 -2.0748 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -5.3632 -2.4948 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5139 -6.1286 -1.6068 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9043 -5.6654 -1.7183 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6762 -5.2196 -0.7566 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2432 -5.1122 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4391 -3.7821 1.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8158 -2.5949 0.6981 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5723 -1.5343 0.6978 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5543 -2.3546 0.2042 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2028 -0.9902 -0.2054 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1193 -0.5863 0.7544 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2856 0.7554 0.6954 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3077 1.1476 1.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8042 0.2243 2.3087 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8783 2.4640 1.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8757 2.9500 0.7481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2326 3.0508 -0.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2123 3.5502 -1.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8634 3.7402 -3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0513 4.6890 -3.7189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7114 5.1791 -3.6845 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 5.9949 -2.6907 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2455 5.7004 -1.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1825 4.5232 -1.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 4.7739 -1.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 3.7237 -1.5281 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1424 3.3918 -0.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3415 2.9909 0.9202 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3069 2.5831 2.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6064 2.1913 3.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6684 1.0338 3.2214 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1094 0.8371 4.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1448 -0.3092 4.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6612 -0.4302 6.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3044 -1.5808 6.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5239 -1.4548 5.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3312 -0.2160 5.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7918 -1.0353 -1.6325 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7857 -1.5015 -2.4663 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.5800 -4.0688 P 0 0 0 0 0 5 0 0 0 0 0 0 1.4524 -2.9843 -4.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2792 -1.1256 -4.2759 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2932 -0.5776 -5.0728 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2164 -1.3648 -5.7618 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0816 -0.5353 -6.6769 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -1.4790 -7.3332 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4766 -0.7534 -4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5611 0.4535 -5.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8266 0.9047 -4.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0564 0.3513 -2.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1736 1.8929 -3.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9929 0.8342 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 -0.6393 -0.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2075 -2.2743 -0.7992 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1556 -0.9059 -1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8157 -1.3390 0.7465 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3783 0.8485 1.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2128 -1.1505 2.7897 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7149 -2.4954 0.5532 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4085 -2.4960 3.6683 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5175 -3.9060 3.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -3.5521 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0306 -5.0735 1.7532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8531 -4.3670 -1.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2133 -6.4924 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1463 -4.8671 0.0855 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9042 -3.3842 -0.4798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9598 -4.1097 -2.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8587 -5.4039 -3.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1343 -6.2648 -0.5942 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5467 -7.2051 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3175 -5.7147 -2.7559 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7005 -4.9221 -1.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1626 -5.3772 0.7747 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7716 -5.8608 1.2892 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5681 -3.5688 1.3619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1281 -3.8310 2.3271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0682 -0.3248 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7451 -1.2666 0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5759 -0.7251 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3779 2.5544 2.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0102 3.1998 1.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1765 3.9675 1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7452 2.3008 0.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0167 1.9430 -0.8756 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3252 3.5938 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6885 4.5278 -1.2933 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1208 2.8533 -1.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6456 2.6607 -3.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9339 3.8321 -3.5686 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7197 5.7085 -3.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2862 4.4364 -4.8893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5727 5.7886 -4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0306 4.2816 -3.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 7.0327 -2.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9534 6.4076 -3.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8787 6.6021 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5498 5.6776 -0.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2673 4.3594 0.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7778 3.5908 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2659 4.8771 -2.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 5.7822 -1.3692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9972 2.7509 -1.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2688 3.8849 -2.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7915 4.2767 0.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9253 2.5936 -0.5012 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7428 3.8443 1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 2.1235 0.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9718 1.7708 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9178 3.4742 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3359 1.9540 4.1233 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0051 3.0680 3.6454 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1558 0.1041 2.8674 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 1.2163 2.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7054 1.7666 5.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9878 0.5637 5.2773 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2592 -0.1671 4.0531 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5995 -1.2780 4.4406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1889 0.4943 6.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5422 -0.6708 6.7847 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2171 -2.5152 5.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6277 -1.7288 7.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3016 -1.5016 4.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1903 -2.3191 5.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8812 0.7022 5.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3265 -0.3374 5.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5302 -0.1835 6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5574 0.0170 -1.9433 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1284 -1.6029 -1.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4252 -0.1647 -4.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7244 -2.1894 -6.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9102 -1.8446 -5.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4691 -0.0379 -7.4586 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6636 0.2250 -6.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9821 -2.4148 -6.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6486 -1.6472 -8.2955 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 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 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 51 52 1 0 52 53 1 0 53 54 1 0 27 55 1 0 55 56 1 0 56 57 1 0 57 58 2 0 57 59 1 0 57 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 6 7 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 12 79 1 0 13 80 1 0 14 81 1 6 15 82 1 0 16 83 1 0 16 84 1 0 17 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 20 89 1 0 21 90 1 0 22 91 1 0 22 92 1 0 23 93 1 0 23 94 1 0 27 95 1 6 28 96 1 0 28 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 35105 1 0 36106 1 0 36107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 0 43121 1 0 44122 1 0 44123 1 0 45124 1 0 45125 1 0 46126 1 0 46127 1 0 47128 1 0 47129 1 0 48130 1 0 48131 1 0 49132 1 0 49133 1 0 50134 1 0 50135 1 0 51136 1 0 51137 1 0 52138 1 0 52139 1 0 53140 1 0 53141 1 0 54142 1 0 54143 1 0 54144 1 0 55145 1 0 55146 1 0 59147 1 0 61148 1 0 61149 1 0 62150 1 0 62151 1 0 63152 1 0 63153 1 0 M END