HMDB0288046 RDKit 3D PC(20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R)/22:2(13Z,16Z)) 150149 0 0 0 0 0 0 0 0999 V2000 -5.3762 -0.6937 -7.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -1.7156 -5.9289 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1583 -1.0649 -4.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0013 -1.0726 -3.6469 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3203 -1.7684 -3.7571 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4334 -0.8083 -3.5738 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3411 -0.8865 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3983 -1.9629 -1.6165 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2542 -1.3489 -0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3466 -1.6082 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2795 -2.6288 0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3332 -3.6715 1.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3447 -3.9670 2.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0421 -3.2734 2.1037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9289 -4.2791 1.8174 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9331 -5.1529 2.9086 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -3.5517 1.6453 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6365 -4.5637 1.5272 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6271 -2.7530 0.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3317 -2.0254 0.1179 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -1.0255 1.2158 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.3381 0.9544 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -0.6636 1.5256 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3058 0.7003 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4861 1.3873 -0.2545 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2462 2.5176 -1.2755 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5370 3.6260 -0.6116 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 4.7359 -1.4372 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 5.9913 -0.5629 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.0612 5.4686 0.6877 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5379 6.8028 -1.5022 O 0 0 0 0 0 1 0 0 0 0 0 0 0.7984 7.1056 -0.0522 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9005 7.0431 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9056 8.0249 -0.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1194 8.1168 -1.1701 N 0 0 0 0 0 4 0 0 0 0 0 0 5.3219 7.9249 -0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1509 7.0785 -2.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2117 9.3847 -1.8947 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6772 1.9613 -2.4265 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4322 1.7750 -3.5458 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6605 2.1350 -3.4665 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 1.2027 -4.8415 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2605 0.7231 -5.5987 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9528 -0.3700 -4.8084 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0505 -1.5738 -4.6848 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6514 -2.6888 -3.9218 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9045 -2.4282 -2.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -3.6186 -1.8732 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -3.6385 -0.4558 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6984 -3.7503 0.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3006 -3.8868 1.8381 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 -4.2385 2.9872 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2979 -4.4491 4.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2609 -3.9887 5.2814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3494 -3.1024 6.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0548 -1.9360 6.5322 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -0.7270 6.5913 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 -0.3046 6.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2685 0.8590 5.2373 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2105 1.2490 4.9933 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3131 2.4903 4.2028 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2951 2.4685 2.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8629 -1.0842 -7.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8979 0.2113 -6.6678 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3248 -0.3731 -7.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4118 -2.2993 -6.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1526 -2.4642 -6.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1809 -0.5218 -4.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7612 -0.5573 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4912 -2.2939 -4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2958 -2.5559 -2.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5284 0.0535 -4.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1411 -0.1217 -2.5698 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8501 -2.8426 -1.8596 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5028 -2.3125 -1.6449 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9989 -0.5773 -0.0143 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -1.0904 1.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4258 -3.0713 -0.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3336 -2.0925 0.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2736 -4.2200 1.5013 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4601 -4.7690 2.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8216 -2.9795 3.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9792 -2.3491 1.5694 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1351 -4.8750 0.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2171 -6.0531 2.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4292 -2.9316 2.5141 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7304 -4.1409 1.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4278 -2.0006 0.3718 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8129 -3.4120 -0.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5287 -2.7907 0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4025 -1.5477 -0.8772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8851 -0.3654 1.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8786 -1.6008 2.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0343 1.7560 0.6169 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1738 0.6590 -0.7602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2941 2.8577 -1.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0987 4.0275 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4439 3.2967 -0.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2819 6.0107 -0.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5428 7.2345 -1.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1859 7.7606 0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4723 9.0677 -0.3832 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1768 8.2616 -0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4254 6.8218 -0.1635 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2704 8.4048 0.6194 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3256 7.1379 -2.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1248 6.0860 -1.6478 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1408 7.0892 -2.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7993 10.2304 -1.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6355 9.2576 -2.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2683 9.5273 -2.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 2.0319 -5.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2409 0.4542 -4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9023 1.6100 -5.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9319 0.3555 -6.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3266 -0.0037 -3.8564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8194 -0.7023 -5.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0458 -1.2938 -4.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8434 -1.9096 -5.7321 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9616 -3.5614 -3.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6213 -2.9813 -4.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9517 -2.1939 -1.9705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5849 -1.5539 -2.3749 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6334 -3.6341 -2.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1194 -4.5774 -2.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5182 -2.7588 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5634 -4.5132 -0.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2089 -4.7360 0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9538 -2.9932 0.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1407 -4.6099 1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7726 -2.9156 2.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9007 -5.2079 2.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5964 -3.5053 3.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1654 -5.1520 3.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1746 -4.3595 5.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5198 -2.8497 5.3124 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9339 -3.7026 6.8858 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 -2.0998 6.9118 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 0.1016 7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7505 0.0735 7.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6071 -1.1289 5.8411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8191 0.7128 4.3109 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 1.7373 5.7652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8013 0.4143 4.6187 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5894 1.4648 6.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0959 3.3831 4.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4126 2.7313 4.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1406 1.7773 2.7465 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4722 2.2232 2.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6283 3.5111 2.5786 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 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 35 38 1 0 26 39 1 0 39 40 1 0 40 41 2 0 40 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 2 0 54 55 1 0 55 56 1 0 56 57 2 0 57 58 1 0 58 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 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 0 7 73 1 0 8 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 15 84 1 6 16 85 1 0 17 86 1 1 18 87 1 0 19 88 1 0 19 89 1 0 20 90 1 0 20 91 1 0 21 92 1 0 21 93 1 0 25 94 1 0 25 95 1 0 26 96 1 6 27 97 1 0 27 98 1 0 33 99 1 0 33100 1 0 34101 1 0 34102 1 0 36103 1 0 36104 1 0 36105 1 0 37106 1 0 37107 1 0 37108 1 0 38109 1 0 38110 1 0 38111 1 0 42112 1 0 42113 1 0 43114 1 0 43115 1 0 44116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 46121 1 0 47122 1 0 47123 1 0 48124 1 0 48125 1 0 49126 1 0 49127 1 0 50128 1 0 50129 1 0 51130 1 0 51131 1 0 52132 1 0 52133 1 0 53134 1 0 54135 1 0 55136 1 0 55137 1 0 56138 1 0 57139 1 0 58140 1 0 58141 1 0 59142 1 0 59143 1 0 60144 1 0 60145 1 0 61146 1 0 61147 1 0 62148 1 0 62149 1 0 62150 1 0 M CHG 2 31 -1 35 1 M END