HMDB0284587 RDKit 3D PE(20:4(7E,9E,11Z,13E)-3OH(5S,6R,15S)/24:1(15Z)) 150149 0 0 0 0 0 0 0 0999 V2000 18.2556 1.3202 1.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7578 1.1574 1.7957 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3426 -0.2003 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8747 -0.4156 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1142 0.6523 0.7008 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5471 0.6298 -0.7454 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3368 -0.6619 -1.4492 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8773 -1.0213 -1.6075 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2853 0.0065 -2.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2539 0.7405 -2.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4474 0.6193 -0.9738 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0857 0.0849 -1.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3026 0.8570 -2.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6098 2.1295 -1.9017 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5784 1.7236 -0.8114 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6315 2.8250 -0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5086 2.4222 0.4091 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0575 1.0957 0.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8587 0.4805 0.5739 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5657 0.9854 0.0652 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0584 2.3250 0.2199 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3247 2.4937 -0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4049 2.3022 -1.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 1.0407 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6682 1.0747 -3.5933 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4459 -0.2535 -2.2095 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0397 -1.3522 -3.0016 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2605 -2.2209 -3.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -2.5124 -2.0608 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6777 -1.4770 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8109 -0.4632 -2.2705 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3369 -1.5584 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7545 -2.0255 -0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -1.0709 -1.2132 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7261 0.2837 -0.5582 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5232 0.9244 -0.2711 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5275 1.1568 -1.5624 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5206 2.4660 -1.0214 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9554 0.6502 -1.3909 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5848 0.9649 -0.2727 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9071 0.6371 0.1491 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3806 1.0671 1.3592 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4621 0.9486 1.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5729 0.8301 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4624 0.0633 1.7194 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6219 -0.2279 2.1436 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6291 -0.9752 1.3549 C 0 0 2 0 0 0 0 0 0 0 0 0 -15.4456 -0.9507 -0.0057 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.9788 -0.2633 1.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0132 -1.0403 0.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4111 -0.4712 1.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7454 -0.5238 2.6227 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.1188 0.0489 2.8274 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9187 -2.1889 -2.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3406 -2.7906 -1.0908 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -3.6953 -0.1613 P 0 0 0 0 0 5 0 0 0 0 0 0 1.1730 -5.1574 -0.5028 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -3.3591 -0.7188 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2128 -3.4206 1.4637 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.1212 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9839 -2.7438 3.6172 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0859 -1.5516 3.5263 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7770 0.4851 2.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3977 1.3614 0.4388 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5621 2.2978 1.9857 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2866 1.9973 1.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6295 1.1832 2.8942 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9364 -1.0078 1.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6164 -0.3341 0.1956 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6517 -0.2902 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5578 -1.4355 1.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3612 1.6230 1.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0116 0.5183 0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8800 1.3862 -1.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5686 0.9926 -0.8716 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7674 -0.6056 -2.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8736 -1.5190 -0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4322 -1.1593 -0.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8909 -2.0300 -2.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7961 0.1857 -3.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8814 1.5134 -2.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2998 1.5766 -0.4513 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8559 -0.0921 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5481 -0.0847 -0.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1979 -0.9705 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4344 0.1756 -2.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8103 1.0772 -3.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0387 2.5191 -2.7637 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 2.8988 -1.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1673 0.7286 -1.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1671 1.5676 0.1261 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0341 3.0472 -1.5179 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0637 3.7624 -0.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9313 2.4726 1.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 3.2212 0.3188 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 0.3242 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1218 1.0003 -1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9266 -0.6429 0.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8493 0.4828 1.7311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7786 0.1881 0.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6697 0.7195 -1.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8881 2.5032 1.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6933 3.1857 -0.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6044 3.5586 -0.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1056 1.8786 0.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1388 3.1719 -2.4257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4859 2.5753 -2.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5114 -1.0544 -3.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0256 -3.1150 -3.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9448 -1.5928 -3.9336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -0.6418 0.3888 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8138 -2.4184 0.3316 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2302 -2.2187 0.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7273 -3.0566 -0.8549 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1048 -0.9040 -2.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5504 -1.5328 -1.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2732 0.1224 0.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5162 1.3563 0.6241 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1708 1.1563 -2.5514 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0409 3.0127 -1.7148 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4362 0.0862 -2.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9366 1.5799 0.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5799 0.0617 -0.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5627 1.7386 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9698 1.6154 3.1464 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8980 1.1320 3.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1712 -0.2469 0.7302 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9416 0.0475 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6972 -1.9889 1.7483 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6680 -1.5228 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1339 -0.4073 2.7029 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9339 0.8075 1.4078 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0591 -2.0852 1.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9106 -1.1046 -0.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.1149 -1.0582 0.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4481 0.5810 0.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.7209 -1.5301 3.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.9942 0.1434 3.1224 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.7836 -0.1422 1.9483 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.6335 -0.3929 3.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.1120 1.1454 3.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4081 -2.9491 -2.8241 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -1.5013 -1.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5623 -2.8657 -0.0345 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9691 -4.0578 2.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0187 -2.3689 1.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5751 -3.5330 4.2434 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9008 -2.2959 4.1055 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1379 -1.8958 3.8803 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -1.4064 2.4760 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 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 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 35 37 1 0 37 38 1 0 37 39 1 0 39 40 2 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 27 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 56 58 1 0 56 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 1 63 1 0 1 64 1 0 1 65 1 0 2 66 1 0 2 67 1 0 3 68 1 0 3 69 1 0 4 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 0 6 75 1 0 7 76 1 0 7 77 1 0 8 78 1 0 8 79 1 0 9 80 1 0 10 81 1 0 11 82 1 0 11 83 1 0 12 84 1 0 12 85 1 0 13 86 1 0 13 87 1 0 14 88 1 0 14 89 1 0 15 90 1 0 15 91 1 0 16 92 1 0 16 93 1 0 17 94 1 0 17 95 1 0 18 96 1 0 18 97 1 0 19 98 1 0 19 99 1 0 20100 1 0 20101 1 0 21102 1 0 21103 1 0 22104 1 0 22105 1 0 23106 1 0 23107 1 0 27108 1 6 28109 1 0 28110 1 0 32111 1 0 32112 1 0 33113 1 0 33114 1 0 34115 1 0 34116 1 0 35117 1 1 36118 1 0 37119 1 6 38120 1 0 39121 1 0 40122 1 0 41123 1 0 42124 1 0 43125 1 0 44126 1 0 45127 1 0 46128 1 0 47129 1 1 48130 1 0 49131 1 0 49132 1 0 50133 1 0 50134 1 0 51135 1 0 51136 1 0 52137 1 0 52138 1 0 53139 1 0 53140 1 0 53141 1 0 54142 1 0 54143 1 0 58144 1 0 60145 1 0 60146 1 0 61147 1 0 61148 1 0 62149 1 0 62150 1 0 M END