HMDB0283735 RDKit 3D PE(20:4(5E,8Z,12Z,14Z)-OH(11R)/22:0) 144143 0 0 0 0 0 0 0 0999 V2000 -4.7727 5.6816 8.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4903 4.9492 7.7827 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6331 5.0839 6.5064 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3104 4.4475 6.7649 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3223 4.5081 5.6336 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8396 3.8845 4.4201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2889 2.8400 3.8291 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1095 2.1643 4.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6627 1.1239 3.6087 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 0.7170 2.4257 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3111 1.6229 1.4028 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9315 -0.6445 1.8171 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7861 -0.8678 0.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 -1.0124 -0.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0785 -0.9957 -0.9541 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.3235 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5656 -2.2336 -2.9784 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -3.4000 -3.9043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3313 -3.1800 -4.9819 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1309 -1.9268 -5.7716 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3503 -1.7368 -6.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3177 -2.5180 -6.5704 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4242 -0.6716 -7.5266 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5878 -0.3999 -8.3191 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7017 0.0533 -7.3202 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9299 0.3556 -8.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9356 0.9089 -7.3131 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 1.2550 -8.0802 P 0 0 0 0 0 5 0 0 0 0 0 0 -7.4614 2.7100 -8.5153 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6898 0.3076 -9.4275 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6069 0.9992 -6.9271 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4232 -0.0637 -7.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5138 -0.2748 -6.2253 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9250 -0.5540 -4.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1497 1.2429 -6.7163 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7427 1.2438 -5.3976 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8861 0.2151 -4.7146 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1093 2.4879 -4.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1719 2.0328 -3.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4001 3.2119 -3.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5689 2.6304 -2.1322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 3.5476 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 2.5983 -0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4655 3.2332 0.2052 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2221 2.0628 0.8634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4338 1.2852 1.8373 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2774 0.0898 2.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5411 -0.6986 3.3244 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3167 -1.9858 3.6797 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5474 -2.6785 4.7653 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0882 -4.0091 5.1564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9903 -4.9814 3.9938 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4191 -6.3608 4.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7765 -6.7750 4.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8623 -6.6280 3.6323 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3465 -5.3102 3.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9825 -4.4992 4.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4514 -3.1620 3.8338 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3301 6.6074 8.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5333 5.9826 9.6719 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0273 5.0211 9.3936 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5062 5.3085 7.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5049 3.8801 8.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5948 6.1643 6.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2025 4.5984 5.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4087 3.4043 7.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8401 5.0267 7.6125 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3793 4.1067 6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1927 5.6196 5.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7481 4.3357 3.9833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7911 2.5081 2.9344 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5907 2.4853 5.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2267 0.5762 3.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4689 0.6005 2.7214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.2222 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1253 -0.5221 1.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1359 -1.3935 2.6213 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8792 -0.9091 0.8294 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0368 -1.1690 -1.4319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8082 -0.9702 -0.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3171 -0.2088 -1.6789 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -3.2744 -1.2459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.2629 -3.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7151 -3.3156 -4.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5776 -4.3681 -3.4575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2894 -3.0910 -4.4273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3428 -4.0551 -5.6701 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -1.0419 -5.1712 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7779 -2.0203 -6.4431 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3681 0.4535 -8.9623 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9206 -1.2449 -8.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7812 -0.7538 -6.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3086 -0.5103 -8.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6881 1.1330 -8.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9132 -0.6122 -9.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8827 -1.0188 -7.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9575 0.2344 -8.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1872 0.5718 -6.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0696 -1.1741 -6.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3639 -0.0592 -4.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8861 -0.3987 -4.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 3.1447 -4.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5797 3.0488 -5.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6874 1.4906 -2.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4328 1.3415 -4.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 3.7349 -3.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0762 3.9042 -2.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2052 1.8265 -2.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0212 2.0864 -1.3317 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0512 4.2988 -0.7695 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1865 4.0588 -2.1208 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8223 1.8306 -1.2532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6587 2.1137 0.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0551 3.8914 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1867 3.8069 -0.4109 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5913 1.3978 0.0433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1473 2.4980 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4918 0.9306 1.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1839 1.9238 2.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4922 -0.5723 1.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2399 0.4499 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5541 -1.0638 2.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -0.0850 4.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3401 -1.7022 3.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4418 -2.5952 2.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5462 -1.9728 5.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4681 -2.7609 4.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1292 -3.9386 5.4718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 -4.4681 6.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -4.5450 3.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8552 -5.0528 3.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6622 -6.7515 5.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0947 -6.9701 3.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1125 -6.3055 5.5923 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7018 -7.8861 4.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 -7.2290 3.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5008 -7.1636 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 -5.5153 2.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 -4.6862 2.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9084 -5.0484 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3362 -4.4436 5.1778 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3828 -3.2159 3.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6401 -2.4596 4.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6439 -2.7097 3.2028 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 2 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 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 27 28 1 0 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 25 35 1 0 35 36 1 0 36 37 2 0 36 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 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 9 73 1 0 10 74 1 1 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 15 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 20 88 1 0 20 89 1 0 24 90 1 0 24 91 1 0 25 92 1 1 26 93 1 0 26 94 1 0 30 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 34100 1 0 34101 1 0 38102 1 0 38103 1 0 39104 1 0 39105 1 0 40106 1 0 40107 1 0 41108 1 0 41109 1 0 42110 1 0 42111 1 0 43112 1 0 43113 1 0 44114 1 0 44115 1 0 45116 1 0 45117 1 0 46118 1 0 46119 1 0 47120 1 0 47121 1 0 48122 1 0 48123 1 0 49124 1 0 49125 1 0 50126 1 0 50127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 53132 1 0 53133 1 0 54134 1 0 54135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 57140 1 0 57141 1 0 58142 1 0 58143 1 0 58144 1 0 M END