HMDB0286938 RDKit 3D PC(20:0/20:4(5Z,8Z,11Z,14Z)-OH(20)) 147146 0 0 0 0 0 0 0 0999 V2000 -2.3222 0.9876 -5.2631 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9478 -0.4431 -4.9842 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4878 -0.6498 -5.2636 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2989 0.2992 -4.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7723 0.1250 -4.5679 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 1.0507 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0284 0.7770 -4.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0089 1.6051 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8869 1.3887 -1.7506 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9394 2.2541 -1.1292 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 2.1970 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7914 2.6252 1.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 4.0387 0.7078 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1597 4.4638 1.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7708 5.8425 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6357 6.4692 1.7667 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2819 5.9118 1.7494 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4238 5.6823 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0316 4.6467 -0.4605 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0619 3.2640 0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 2.2948 -0.5801 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 3.0153 1.3749 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7051 1.9388 2.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8021 0.9798 1.7953 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4792 -0.0035 0.7215 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1974 -0.5556 0.9661 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2131 -1.6799 -0.1951 P 0 0 0 0 0 5 0 0 0 0 0 0 1.1702 -1.1407 -1.2158 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1882 -2.1665 -1.0193 O 0 0 0 0 0 1 0 0 0 0 0 0 0.9050 -3.0401 0.5681 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8298 -3.6451 -0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4876 -4.8476 0.3207 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4455 -5.4368 -0.6176 N 0 0 0 0 0 4 0 0 0 0 0 0 2.8070 -5.6728 -1.9092 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5696 -4.5644 -0.8417 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8865 -6.6991 -0.1059 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0382 1.6259 1.6518 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 1.4823 2.4532 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1139 0.6848 3.4083 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3933 2.3159 2.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5785 2.3551 0.6326 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9418 0.9605 0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9706 0.9550 -1.3553 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2454 0.1157 -2.0451 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3294 -0.9302 -1.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7437 -2.2337 -2.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1884 -3.2922 -1.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3736 -3.3817 -0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5839 -4.4804 0.5563 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6781 -4.3744 1.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2941 -3.0899 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6039 -3.2347 3.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -3.1587 4.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3402 -2.9071 4.3977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -4.0679 4.9598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8367 -5.3755 4.2715 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -6.4794 4.8827 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2818 -7.7861 4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0323 -7.6247 2.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3584 1.0504 -5.6888 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5968 1.5095 -5.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 1.5299 -4.2832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5304 -1.1420 -5.6344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0984 -0.7351 -3.9075 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1779 -1.7000 -5.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2895 -0.4333 -6.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0278 1.3334 -4.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.1496 -3.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0742 -0.9322 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0185 0.3627 -5.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3585 2.1141 -3.9434 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3296 0.8595 -2.6517 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2257 0.8473 -5.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1882 -0.3180 -3.7789 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8797 2.6950 -3.4474 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0541 1.3635 -3.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1039 0.3372 -1.5467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8573 1.7009 -1.4578 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9163 1.9555 -1.5943 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7068 3.3151 -1.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2292 1.1174 0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9169 2.7459 0.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9485 1.9289 0.7948 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9361 2.5573 2.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 4.0644 -0.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 4.7358 0.9594 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3875 4.4740 2.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3998 3.7089 1.3593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7464 5.9813 -0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6875 6.4857 1.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6468 7.5817 1.5172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9257 6.5225 2.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3662 6.6496 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2749 5.0219 2.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3803 6.6640 -0.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5352 5.5465 0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 4.6465 -1.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9884 4.7689 -0.9557 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8854 2.3206 3.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2088 1.2828 2.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8912 0.2996 2.7426 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4792 0.3640 -0.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2171 -0.8596 0.7221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3057 -3.9747 -1.2033 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5828 -2.8810 -0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0511 -4.6277 1.2505 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7773 -5.6556 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7319 -5.9174 -1.7578 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3763 -6.4632 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8513 -4.7550 -2.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7849 -3.9447 0.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3573 -3.8584 -1.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4828 -5.0986 -1.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4266 -6.6122 0.8581 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6353 -7.1215 -0.8402 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0361 -7.4015 -0.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2486 3.2912 2.5898 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2374 1.7440 2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6477 2.7251 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4236 3.0822 0.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2145 0.2878 0.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9324 0.7032 0.5641 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6234 1.6814 -1.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2964 0.1667 -3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3081 -0.6457 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2477 -0.9893 -0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6609 -2.3208 -3.2037 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4609 -4.2108 -2.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4643 -3.7092 0.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -2.4328 0.4816 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7906 -5.4813 0.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1788 -5.2953 1.8095 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2476 -2.9285 1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9232 -2.2603 1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6571 -3.4303 3.8391 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1137 -3.2843 5.6377 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0776 -2.8333 3.3539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0069 -2.0084 4.9922 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -4.2205 6.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5524 -3.8702 4.9283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5394 -5.3108 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8837 -5.6738 4.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -6.5632 5.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0887 -6.2634 4.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -8.1107 4.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3915 -8.5606 4.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -6.9554 2.7196 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 1 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 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 24 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 0 3 66 1 0 4 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 0 6 72 1 0 7 73 1 0 7 74 1 0 8 75 1 0 8 76 1 0 9 77 1 0 9 78 1 0 10 79 1 0 10 80 1 0 11 81 1 0 11 82 1 0 12 83 1 0 12 84 1 0 13 85 1 0 13 86 1 0 14 87 1 0 14 88 1 0 15 89 1 0 15 90 1 0 16 91 1 0 16 92 1 0 17 93 1 0 17 94 1 0 18 95 1 0 18 96 1 0 19 97 1 0 19 98 1 0 23 99 1 0 23100 1 0 24101 1 1 25102 1 0 25103 1 0 31104 1 0 31105 1 0 32106 1 0 32107 1 0 34108 1 0 34109 1 0 34110 1 0 35111 1 0 35112 1 0 35113 1 0 36114 1 0 36115 1 0 36116 1 0 40117 1 0 40118 1 0 41119 1 0 41120 1 0 42121 1 0 42122 1 0 43123 1 0 44124 1 0 45125 1 0 45126 1 0 46127 1 0 47128 1 0 48129 1 0 48130 1 0 49131 1 0 50132 1 0 51133 1 0 51134 1 0 52135 1 0 53136 1 0 54137 1 0 54138 1 0 55139 1 0 55140 1 0 56141 1 0 56142 1 0 57143 1 0 57144 1 0 58145 1 0 58146 1 0 59147 1 0 M CHG 2 29 -1 33 1 M END