HMDB0288678 RDKit 3D PC(24:0/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)) 162161 0 0 0 0 0 0 0 0999 V2000 2.7955 1.2897 -2.7798 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1772 2.5996 -3.3037 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2243 3.5612 -3.6433 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2913 4.7352 -3.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3996 5.3006 -2.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7412 6.5716 -2.5833 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8332 7.4400 -2.8798 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9073 7.2962 -1.6354 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4139 6.8846 -0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3967 7.8356 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9278 7.5134 1.4192 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7726 6.2165 2.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3512 5.9782 3.2318 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2341 4.7112 3.9289 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6997 3.6670 3.1043 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0047 4.7057 5.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4168 4.8953 5.0946 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3403 4.0758 5.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0399 2.8351 6.2435 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5365 1.5893 5.6334 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8001 0.5691 5.2681 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3311 0.5095 5.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 0.2890 4.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9462 -1.0360 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6511 -1.9211 3.9879 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4046 -1.2805 2.2495 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4968 -2.4157 1.4533 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1622 -2.8623 0.9568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1947 -3.9979 0.1535 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -4.4344 -0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -3.7666 -0.0075 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2518 -5.6023 -1.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5216 -5.2929 -2.6377 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7342 -4.4565 -2.8778 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9637 -5.1331 -2.3586 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2052 -4.2703 -2.6009 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4347 -4.9516 -2.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6936 -4.1756 -2.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6633 -2.8184 -1.6026 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3887 -2.8442 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3755 -1.4596 0.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0549 -1.5861 1.9285 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0165 -0.2615 2.6669 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0252 0.6880 2.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6252 0.1719 2.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7123 1.2047 1.4564 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2697 0.7555 1.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4008 1.8168 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0392 1.3706 0.6445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8206 2.4782 -0.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 2.1310 -0.1725 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9854 3.2746 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4538 3.5810 -2.2307 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 2.4269 -3.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3322 -2.0644 0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6197 -1.6647 0.5732 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4634 -1.3169 -0.8492 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.6874 -1.7507 -2.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9421 0.2887 -0.9210 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.8814 -2.2647 -0.8202 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3607 -2.3197 -2.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6294 -3.1596 -2.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3511 -4.4972 -1.6245 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.5305 -5.3021 -1.9831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2191 -5.0734 -2.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2377 -4.5870 -0.1863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0836 0.7128 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2085 0.6968 -3.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 1.5828 -2.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 2.9094 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5543 2.2933 -4.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9636 3.2424 -4.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1419 5.3727 -3.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6074 4.6632 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0433 5.5436 -1.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.3921 -3.5667 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5642 7.3124 -2.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6764 8.3437 -1.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 5.8875 -0.1751 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5718 8.8558 -0.1486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5191 8.2623 1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1812 5.4433 1.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9371 6.7818 3.6664 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 4.4951 4.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 3.5667 3.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4891 5.4903 5.8613 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7328 3.7522 5.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7752 5.8068 4.5725 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 4.3040 5.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0548 2.7729 6.7223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7211 2.9239 7.1965 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6101 1.5099 5.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2849 -0.3304 4.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0643 -0.3136 6.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9661 1.4269 5.8809 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0561 1.0375 3.3921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5573 0.3405 4.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0722 -3.2452 1.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5725 -3.0441 1.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2421 -2.0168 0.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -6.2454 -0.8337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3787 -6.3171 -1.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5958 -6.2719 -3.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.8304 -3.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8531 -4.3925 -3.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 -3.4093 -2.5318 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0804 -6.0905 -2.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8747 -5.3429 -1.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3278 -4.0781 -3.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0196 -3.3036 -2.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2838 -5.3272 -1.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -5.8887 -2.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5949 -4.6930 -1.8975 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8113 -4.0073 -3.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7118 -2.4075 -1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0286 -2.1178 -2.1537 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1378 -3.4758 0.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3964 -3.3401 0.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6771 -0.8087 -0.0774 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3867 -1.0092 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1614 -2.1956 2.0815 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9019 -2.1581 2.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7276 -0.4795 3.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0374 0.1460 2.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0179 1.5966 2.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 1.0945 1.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5272 -0.7686 1.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 -0.0257 3.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0221 1.4144 0.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 2.1853 1.9726 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1702 -0.2175 0.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9215 0.6496 2.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4578 2.7655 1.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8355 2.0865 -0.2305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4348 1.2752 1.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1293 0.4018 0.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3659 2.6576 -1.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7313 3.3791 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7343 2.0306 0.8446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3626 1.1951 -0.7442 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8376 4.2314 -0.2668 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0946 3.1477 -0.8711 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 3.9080 -2.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 4.3891 -2.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1453 2.6593 -4.1014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5363 2.1774 -3.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9351 1.5485 -2.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8928 -1.1630 -0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4219 -2.8957 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5388 -1.3277 -2.5657 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5869 -2.8014 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3393 -2.6566 -1.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0102 -3.2257 -3.1218 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5139 -5.5685 -3.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4071 -4.6282 -1.7607 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5554 -6.1685 -1.2998 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2898 -4.9122 -1.7162 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3684 -6.1846 -2.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0880 -4.7014 -3.3283 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7829 -5.4891 0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -3.7145 0.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1727 -4.7356 0.1490 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 63 64 1 0 63 65 1 0 63 66 1 0 1 67 1 0 1 68 1 0 1 69 1 0 2 70 1 0 2 71 1 0 3 72 1 0 4 73 1 0 5 74 1 0 5 75 1 0 6 76 1 6 7 77 1 0 8 78 1 0 9 79 1 0 10 80 1 0 11 81 1 0 12 82 1 0 13 83 1 0 14 84 1 1 15 85 1 0 16 86 1 0 16 87 1 0 17 88 1 0 18 89 1 0 19 90 1 0 19 91 1 0 20 92 1 0 21 93 1 0 22 94 1 0 22 95 1 0 23 96 1 0 23 97 1 0 27 98 1 1 28 99 1 0 28100 1 0 32101 1 0 32102 1 0 33103 1 0 33104 1 0 34105 1 0 34106 1 0 35107 1 0 35108 1 0 36109 1 0 36110 1 0 37111 1 0 37112 1 0 38113 1 0 38114 1 0 39115 1 0 39116 1 0 40117 1 0 40118 1 0 41119 1 0 41120 1 0 42121 1 0 42122 1 0 43123 1 0 43124 1 0 44125 1 0 44126 1 0 45127 1 0 45128 1 0 46129 1 0 46130 1 0 47131 1 0 47132 1 0 48133 1 0 48134 1 0 49135 1 0 49136 1 0 50137 1 0 50138 1 0 51139 1 0 51140 1 0 52141 1 0 52142 1 0 53143 1 0 53144 1 0 54145 1 0 54146 1 0 54147 1 0 55148 1 0 55149 1 0 61150 1 0 61151 1 0 62152 1 0 62153 1 0 64154 1 0 64155 1 0 64156 1 0 65157 1 0 65158 1 0 65159 1 0 66160 1 0 66161 1 0 66162 1 0 M CHG 2 59 -1 63 1 M END