HMDB0289784 RDKit 3D PC(20:4(6E,8Z,11Z,14Z)+=O(5)/P-18:1(9Z)) 136135 0 0 0 0 0 0 0 0999 V2000 -0.1182 3.7531 1.8437 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5339 3.3040 1.6935 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8546 2.1062 2.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6502 2.4492 4.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9955 1.2053 4.8663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8255 1.5496 6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 1.0206 7.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0634 -0.0574 6.9585 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1789 -0.7175 5.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0198 -2.0100 5.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5127 -2.9033 6.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7377 -3.6398 6.4478 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6348 -3.6855 5.5413 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5955 -2.9615 4.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5656 -3.0628 3.3971 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -2.3149 2.1482 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4889 -1.5842 1.9578 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5568 -2.4175 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1834 -1.8552 -0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3542 -2.0090 -1.1424 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1445 -1.5674 -2.5184 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1634 -1.2832 -3.2406 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9098 -1.4242 -3.1444 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8733 -0.9884 -4.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -0.9344 -5.0304 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9290 -2.3584 -5.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8098 -2.8572 -3.7463 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -4.4294 -3.7462 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.0467 -4.9637 -5.1467 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3362 -5.4156 -2.9152 O 0 0 0 0 0 1 0 0 0 0 0 0 0.2580 -4.5470 -2.9501 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1133 -5.3826 -3.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4532 -5.5245 -3.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4093 -6.0703 -1.6819 N 0 0 0 0 0 4 0 0 0 0 0 0 3.3595 -7.1579 -1.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1075 -6.5553 -1.2792 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8018 -5.0301 -0.7489 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6318 -0.0633 -4.3328 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9319 1.2744 -4.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0484 2.1844 -3.8238 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4185 3.6047 -3.7693 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5753 4.5460 -4.5063 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8411 4.7695 -4.2111 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2529 5.3207 -2.8986 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0876 4.5724 -1.6549 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9305 3.2904 -1.5529 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3589 3.6247 -1.6356 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1607 3.1667 -2.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8144 2.2339 -3.6205 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6978 1.0582 -3.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8777 0.0276 -2.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 -0.9430 -2.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6219 -0.7634 -1.6352 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6075 -0.1255 -0.2982 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2434 -0.1810 0.3152 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1861 0.4832 -0.4823 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5985 2.9108 1.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 4.2998 2.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1499 4.4742 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 4.1372 1.9325 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7256 3.0297 0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 1.2611 2.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9297 1.8825 2.4216 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3408 3.2787 4.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6147 2.7537 4.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1392 1.1566 4.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5335 0.3353 4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5057 2.4026 6.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1094 1.4878 8.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2296 -0.7335 7.8493 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 0.3614 7.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5965 -0.1377 4.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2754 -2.3787 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3026 -2.5364 7.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3061 -3.7776 6.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9521 -4.2930 7.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5527 -4.3295 5.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8211 -2.2895 4.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4128 -3.7240 3.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9563 -3.4473 1.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -1.7799 1.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9578 -0.7816 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -2.4402 -0.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -3.0637 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1923 -1.3790 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4558 -1.7410 -5.0716 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4089 -0.0191 -4.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5179 -0.6121 -6.0883 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9726 -2.3915 -5.5999 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6741 -2.9735 -5.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -4.8593 -4.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6552 -6.3496 -3.9349 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0709 -6.2164 -3.6306 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9409 -4.5280 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0872 -8.0625 -2.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3097 -7.4479 -0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3857 -6.8293 -1.7189 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5682 -7.1103 -2.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -5.7417 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2949 -7.2807 -0.4441 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5713 -5.3759 -0.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9078 -4.6780 -0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 -4.1315 -1.2991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9016 1.6273 -4.5682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0994 1.7573 -3.5476 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6803 3.9010 -2.7207 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4541 3.6745 -4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6452 4.2288 -5.6137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0979 5.5570 -4.4603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3838 3.7905 -4.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2924 5.4728 -4.9891 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3414 5.6522 -2.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7231 6.3434 -2.8388 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4367 5.2708 -0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0651 4.3406 -1.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5986 2.5873 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7253 2.9088 -0.5363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 4.3284 -0.8472 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2305 3.4984 -2.5084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7408 1.9767 -3.7002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.8332 -4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7633 1.5288 -3.8444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5752 0.5663 -4.7523 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3595 0.5721 -1.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -0.5493 -3.0416 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6945 -1.6975 -3.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4979 -1.7007 -1.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0994 -1.7677 -1.4976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8823 -0.2193 -2.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9486 0.9226 -0.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2627 -0.7580 0.3811 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9277 -1.2458 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2824 0.2531 1.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0551 1.4554 0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4839 0.7594 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7533 -0.1340 -0.5541 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 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 16 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 34 35 1 0 34 36 1 0 34 37 1 0 25 38 1 0 38 39 1 0 39 40 2 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 2 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 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 15 79 1 0 18 80 1 0 18 81 1 0 19 82 1 0 19 83 1 0 20 84 1 0 20 85 1 0 24 86 1 0 24 87 1 0 25 88 1 6 26 89 1 0 26 90 1 0 32 91 1 0 32 92 1 0 33 93 1 0 33 94 1 0 35 95 1 0 35 96 1 0 35 97 1 0 36 98 1 0 36 99 1 0 36100 1 0 37101 1 0 37102 1 0 37103 1 0 39104 1 0 40105 1 0 41106 1 0 41107 1 0 42108 1 0 42109 1 0 43110 1 0 43111 1 0 44112 1 0 44113 1 0 45114 1 0 45115 1 0 46116 1 0 46117 1 0 47118 1 0 48119 1 0 49120 1 0 49121 1 0 50122 1 0 50123 1 0 51124 1 0 51125 1 0 52126 1 0 52127 1 0 53128 1 0 53129 1 0 54130 1 0 54131 1 0 55132 1 0 55133 1 0 56134 1 0 56135 1 0 56136 1 0 M CHG 2 30 -1 34 1 M END