HMDB0266352 RDKit 3D PA(20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R)/24:0) 143142 0 0 0 0 0 0 0 0999 V2000 15.1688 -2.2541 -3.7632 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6896 -2.6501 -2.4028 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8256 -1.7827 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8570 -1.0087 -0.9747 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7766 -0.8363 0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3932 0.5790 0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2913 1.2043 -0.0547 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9925 0.7212 -0.4632 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8624 -0.6722 -0.8085 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1091 -1.5202 -0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 -1.2308 1.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8206 -1.4623 0.7593 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9359 -0.4906 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2256 0.8766 1.2911 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8733 1.9652 0.3426 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3049 3.1683 1.0086 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4214 2.2069 0.0811 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9059 1.0794 -0.6019 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6451 2.4421 1.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2106 2.7581 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3535 1.8117 0.4368 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2632 0.4399 0.9706 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1301 -0.0128 1.7309 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2024 -0.3702 0.6333 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -1.6922 1.0337 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5539 -2.0376 0.5363 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4208 -1.7541 -0.9382 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1777 -2.6452 -1.6921 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9769 -2.2763 -3.3206 P 0 0 0 0 0 5 0 0 0 0 0 0 1.0185 -3.3041 -3.9099 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -2.4069 -4.1064 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3499 -0.7409 -3.5644 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7474 -1.1007 1.2967 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -1.5555 2.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3909 -2.8069 2.2388 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0141 -0.6284 2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4718 0.7626 2.8084 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 1.8059 3.6466 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5534 2.0241 3.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8903 2.4421 2.0846 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3548 2.7497 1.9181 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2769 1.6228 2.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1532 0.4267 1.3121 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4333 0.7988 -0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8335 1.4076 -0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2129 1.7902 -1.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5147 2.4491 -1.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7959 1.8310 -1.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1150 1.3252 -0.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6174 0.8951 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0166 0.3637 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4466 -0.0401 1.2777 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8880 -1.1072 0.3194 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3457 -1.3957 0.5509 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9235 -2.4472 -0.3467 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8420 -2.1014 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4447 -3.1864 -2.6794 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9079 -3.3796 -2.3401 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1362 -1.1620 -3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7863 -2.7225 -4.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1489 -2.6794 -3.8937 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1361 -3.6971 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9215 -2.7748 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6910 -1.8189 -2.6826 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7903 -0.4215 -0.8189 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2960 -1.0785 1.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9494 -1.5384 -0.0977 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2802 1.2290 0.4542 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3621 2.3408 0.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2592 1.0385 0.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6730 1.3159 -1.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4094 -1.0389 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0864 -2.5466 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5667 -2.0731 1.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5190 -0.3334 1.5606 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4867 -2.4619 0.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8843 -0.7477 0.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2714 1.0690 1.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6269 1.0706 2.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4258 1.9641 -0.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5492 3.8340 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3454 3.0597 -0.6008 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3194 1.0996 -1.5017 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1527 3.3018 1.8811 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7832 1.5807 2.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7509 2.9038 2.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 3.7838 0.7005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2797 2.1771 0.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6708 1.7650 -0.6509 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6773 -2.4309 0.6157 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0184 -1.7864 2.1329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2459 -3.0344 0.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3668 -1.8161 -1.2206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7629 -0.7081 -1.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -1.9418 -3.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7538 -0.7118 -4.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9936 -0.9511 4.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.6926 2.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6076 0.7091 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4642 1.0165 1.7163 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8487 1.5851 4.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5563 2.7739 3.4317 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0904 1.0948 3.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 2.8432 4.1631 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 3.3554 1.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6279 1.6604 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5914 3.5656 2.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5315 3.2303 0.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0309 1.2539 3.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3407 1.9665 2.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1542 0.0024 1.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9469 -0.2888 1.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4597 -0.1448 -0.7131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7005 1.4707 -0.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 0.8018 0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7428 2.3845 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0404 0.9531 -2.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4288 2.5494 -1.9321 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4071 3.4618 -1.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6174 2.8562 -2.8347 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0601 1.0329 -2.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6008 2.6189 -1.6802 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6406 0.3561 0.1896 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0600 2.0352 0.7315 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1660 1.7840 -0.4834 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6260 0.0686 -0.9117 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7606 1.1416 1.9438 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3356 -0.4865 1.4246 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6018 -0.4335 2.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1298 0.8413 1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3393 -2.0575 0.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7732 -0.8160 -0.7409 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5246 -1.7553 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9469 -0.4657 0.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0148 -2.5940 -0.0932 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4705 -3.4487 -0.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4016 -1.1674 -2.0434 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7581 -1.9913 -2.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8993 -4.1536 -2.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3810 -2.8231 -3.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2381 -2.5197 -1.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.5504 -3.3474 -3.2522 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0482 -4.3350 -1.8290 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 26 33 1 0 33 34 1 0 34 35 2 0 34 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 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 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 14 79 1 0 15 80 1 6 16 81 1 0 17 82 1 6 18 83 1 0 19 84 1 0 19 85 1 0 20 86 1 0 20 87 1 0 21 88 1 0 21 89 1 0 25 90 1 0 25 91 1 0 26 92 1 6 27 93 1 0 27 94 1 0 31 95 1 0 32 96 1 0 36 97 1 0 36 98 1 0 37 99 1 0 37100 1 0 38101 1 0 38102 1 0 39103 1 0 39104 1 0 40105 1 0 40106 1 0 41107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 50125 1 0 50126 1 0 51127 1 0 51128 1 0 52129 1 0 52130 1 0 53131 1 0 53132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 56137 1 0 56138 1 0 57139 1 0 57140 1 0 58141 1 0 58142 1 0 58143 1 0 M END