HMDB0273400 RDKit 3D PGP(22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)/20:2(11Z,14Z)) 145144 0 0 0 0 0 0 0 0999 V2000 9.7097 -4.6742 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5353 -3.2403 1.6895 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0864 -2.4000 0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9331 -1.7173 0.5584 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0038 -1.7711 1.6741 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6376 -2.3142 1.4228 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9248 -2.3521 2.6999 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7473 -1.4257 0.6429 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0334 -0.3194 0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9482 0.3546 -0.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1123 1.4741 -1.3296 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3466 2.1766 -1.4739 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9581 2.4291 -2.7684 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5962 2.0321 -3.9245 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4587 1.2004 -4.2186 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 0.8439 -5.4687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9531 -0.0157 -5.6482 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0640 -1.1845 -4.8699 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6676 0.6445 -5.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 0.4004 -6.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5346 -0.6179 -7.2134 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5182 -1.6933 -6.8325 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2257 -2.2199 -5.4797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0651 -3.3104 -4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5523 -4.1236 -5.8406 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3601 -3.5187 -3.6829 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1122 -4.5724 -3.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3565 -4.2872 -1.6726 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3690 -3.2370 -1.1845 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0258 -2.4728 -0.2056 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0518 -1.1014 0.1374 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.2729 -0.7615 1.5854 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -1.4846 -0.1127 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5969 0.1449 -0.8652 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6614 1.0847 -1.2105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2854 2.0457 -2.2142 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5942 1.3510 -3.3995 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6405 2.5552 -1.7306 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1738 3.3681 -2.7251 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6916 3.9721 -2.3830 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.6466 5.4903 -2.5205 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1956 3.5047 -0.8449 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8575 3.3808 -3.4845 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8817 -5.1889 -0.8378 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0974 -5.1237 -0.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7966 -4.0827 -0.4964 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7389 -6.0548 0.7153 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3294 -5.1599 1.8587 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -4.4587 2.5066 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6698 -3.4500 3.5191 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -2.7787 4.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8282 -1.6442 5.1047 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -0.5351 4.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8437 0.6745 5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5549 1.7109 4.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7074 2.1067 3.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3025 3.3359 2.9447 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6417 4.4554 3.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4566 5.1333 4.3962 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2303 5.2389 5.6602 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1188 4.6922 6.7235 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2945 3.7367 7.5785 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1361 3.1310 8.6906 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2471 2.2378 9.5128 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6328 1.1209 8.7169 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5336 -4.6769 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7343 -5.0067 1.3583 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0257 -5.3501 1.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5755 -2.8925 1.9706 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9362 -3.2781 2.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7582 -2.3256 -0.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -1.1546 -0.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8057 -0.6429 1.9162 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4265 -2.0953 2.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6745 -3.3487 1.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9927 -2.5589 2.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6833 -1.7704 0.5772 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0306 0.1159 0.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -0.1049 -0.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1488 1.8696 -1.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1409 3.2421 -1.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1421 1.8480 -0.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9246 3.0843 -2.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2241 2.3628 -4.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8357 0.8052 -3.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7612 1.2257 -6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0192 -0.3817 -6.7074 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 -1.1089 -4.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5959 1.4296 -4.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3247 0.9763 -5.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4319 -1.1555 -7.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0571 -0.1660 -8.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5403 -1.2476 -6.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5222 -2.5237 -7.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8596 -2.5138 -5.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2846 -1.3946 -4.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5464 -5.5177 -3.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0733 -4.6061 -3.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2949 -3.5157 -1.8113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1893 -2.5610 -2.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4174 -3.6539 -0.8687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7483 -2.3109 0.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3418 1.6607 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.6084 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5914 2.8429 -2.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6126 0.3719 -3.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4958 3.0299 -0.7643 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3451 1.6924 -1.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4994 2.5617 -0.9245 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 2.6251 -3.9534 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1117 -6.7867 1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6024 -6.5353 0.2508 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0419 -4.4477 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7963 -5.8543 2.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4758 -3.9689 1.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5408 -5.1816 3.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2989 -3.9203 4.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2888 -2.6751 3.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7229 -2.4765 3.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0105 -3.5890 4.8102 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8818 -1.1962 5.4895 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3736 -1.9949 5.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4705 -0.9523 3.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8369 -0.2799 3.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 0.5184 6.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8754 1.1881 5.4578 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0142 2.4914 4.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4054 1.1077 3.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4344 1.2948 2.4507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6598 3.5032 2.0314 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0267 5.2687 3.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4985 4.3335 4.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7204 5.5739 3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3014 5.7857 5.9641 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9747 4.1662 6.2873 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5288 5.5308 7.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 2.9667 6.9196 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4755 4.3428 8.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4359 3.9798 9.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0546 2.6732 8.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7697 1.8802 10.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4226 2.9038 9.9076 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3409 0.6975 8.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2204 0.3503 9.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7607 1.5222 8.1198 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 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 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 1 0 31 32 2 0 31 33 1 0 31 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 40 43 1 0 28 44 1 0 44 45 1 0 45 46 2 0 45 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 2 0 57 58 1 0 58 59 1 0 59 60 2 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 64 65 1 0 1 66 1 0 1 67 1 0 1 68 1 0 2 69 1 0 2 70 1 0 3 71 1 0 4 72 1 0 5 73 1 0 5 74 1 0 6 75 1 6 7 76 1 0 8 77 1 0 9 78 1 0 10 79 1 0 11 80 1 0 12 81 1 0 12 82 1 0 13 83 1 0 14 84 1 0 15 85 1 0 16 86 1 0 17 87 1 6 18 88 1 0 19 89 1 0 20 90 1 0 21 91 1 0 21 92 1 0 22 93 1 0 22 94 1 0 23 95 1 0 23 96 1 0 27 97 1 0 27 98 1 0 28 99 1 6 29100 1 0 29101 1 0 33102 1 0 35103 1 0 35104 1 0 36105 1 6 37106 1 0 38107 1 0 38108 1 0 42109 1 0 43110 1 0 47111 1 0 47112 1 0 48113 1 0 48114 1 0 49115 1 0 49116 1 0 50117 1 0 50118 1 0 51119 1 0 51120 1 0 52121 1 0 52122 1 0 53123 1 0 53124 1 0 54125 1 0 54126 1 0 55127 1 0 55128 1 0 56129 1 0 57130 1 0 58131 1 0 58132 1 0 59133 1 0 60134 1 0 61135 1 0 61136 1 0 62137 1 0 62138 1 0 63139 1 0 63140 1 0 64141 1 0 64142 1 0 65143 1 0 65144 1 0 65145 1 0 M END