HMDB0288260 RDKit 3D PC(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)) 147146 0 0 0 0 0 0 0 0999 V2000 -0.1510 -0.4691 2.3614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0985 -1.6136 2.6947 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4233 -1.1379 3.1099 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9311 -1.4154 4.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2512 -2.2159 5.3192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0374 -3.4910 5.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3911 -4.2324 6.6148 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1124 -4.3219 4.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0397 -4.8875 3.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -5.7026 2.6948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -6.2344 2.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6545 -7.0514 1.1248 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1908 -6.6819 0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8904 -5.6086 -0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9976 -4.4302 0.7696 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4243 -4.4339 1.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2498 -3.4772 0.9924 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8846 -2.2413 0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7382 -2.1779 -0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6174 -1.2519 -1.2444 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8601 -0.1358 -0.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 1.2156 -0.9458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3547 1.5367 -1.4811 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1967 2.7380 -1.8912 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2344 0.7312 -1.6263 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0443 1.2387 -2.1840 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0729 1.0764 -1.1556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2694 1.6122 -1.6679 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4514 1.6070 -0.9999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5594 1.1184 0.1271 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6984 2.2061 -1.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 1.1979 -1.7783 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0221 1.6532 -2.3967 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0191 2.1735 -3.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4876 3.4399 -4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0996 4.6511 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6174 5.7090 -3.2804 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2137 6.0850 -3.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1002 6.5251 -1.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2179 6.1100 -0.8219 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1393 5.1290 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8436 5.8735 -0.8987 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0319 5.5108 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1466 4.3454 0.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 4.9131 2.2841 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7403 4.5571 3.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7632 3.5508 2.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 2.4274 3.9816 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 2.9221 5.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 3.4783 5.7165 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 2.4207 5.5327 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5762 0.4966 -3.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4633 0.5163 -4.4646 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7334 -0.3663 -5.7451 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.7408 -0.5758 -5.4766 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8845 0.5291 -7.1809 O 0 0 0 0 0 1 0 0 0 0 0 0 1.5275 -1.8319 -5.9385 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -2.0358 -7.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7263 -3.3611 -7.2942 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8379 -3.4362 -6.3933 N 0 0 0 0 0 4 0 0 0 0 0 0 5.0301 -3.9787 -7.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4605 -4.3185 -5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2118 -2.1806 -5.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7149 0.4857 2.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1489 -0.4634 1.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.5012 2.9674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2296 -2.1522 1.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5838 -2.2465 3.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0445 -0.5291 2.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9489 -1.0304 4.5538 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3683 -1.6095 6.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1897 -2.3697 5.2264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0293 -3.2122 5.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4674 -3.8583 6.7581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0499 -4.4555 3.8763 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1152 -4.7068 4.4591 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8299 -5.9097 2.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0417 -6.0386 2.9819 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3863 -8.1494 1.4421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6901 -7.2812 0.6584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2456 -7.4797 -0.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4837 -5.5781 -1.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7942 -3.5433 0.0852 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3282 -4.4217 1.5872 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8101 -5.3044 1.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3002 -3.5491 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -1.4076 0.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8306 -2.1896 0.0322 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5881 -2.9941 -1.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1719 -1.3211 -2.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4084 -0.2518 0.6411 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9983 -0.1554 -0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0027 2.0321 -0.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4103 1.3017 -1.7882 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2063 2.3093 -2.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1746 1.5589 -0.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2343 -0.0256 -1.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0474 2.9727 -0.8764 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4028 2.7390 -2.5315 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0102 0.7455 -0.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3705 0.2832 -2.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7886 0.7843 -2.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5158 2.3774 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5677 1.3082 -4.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1268 2.0680 -4.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3933 3.4468 -4.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7952 3.4226 -5.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2387 4.6238 -3.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3562 6.5478 -2.9573 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0107 6.9913 -3.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5061 5.2823 -3.2402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8258 7.2751 -1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 6.4864 0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1339 4.6642 -2.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 4.3415 -0.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 6.7271 -1.5469 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9489 6.1082 0.0783 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0825 3.8148 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7324 3.6929 0.6787 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8551 5.6649 2.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7032 5.0250 4.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8204 3.0575 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7622 3.9636 3.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4628 2.0770 3.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2216 1.5921 3.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4505 2.0372 6.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8764 3.6684 5.6784 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2072 4.4194 5.1987 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9624 3.7059 6.8241 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9279 2.6433 6.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 2.3410 4.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6005 1.4532 5.8848 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4244 0.9192 -3.6636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4749 -0.5844 -3.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1431 -2.1353 -7.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6044 -1.1957 -7.6138 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9921 -4.1625 -7.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1145 -3.4538 -8.3276 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2299 -3.5095 -7.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8961 -3.7411 -6.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9707 -5.0800 -7.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4073 -4.1436 -5.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6077 -5.3747 -5.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0518 -4.0606 -4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2836 -1.3556 -6.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6094 -1.9113 -4.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2569 -2.3244 -5.3907 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 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 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 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 26 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 54 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 60 62 1 0 60 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 7 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 14 82 1 0 15 83 1 0 15 84 1 0 16 85 1 0 17 86 1 0 18 87 1 0 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 26 95 1 6 27 96 1 0 27 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 36108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 40113 1 0 41114 1 0 41115 1 0 42116 1 0 43117 1 0 44118 1 0 44119 1 0 45120 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 51132 1 0 52133 1 0 52134 1 0 58135 1 0 58136 1 0 59137 1 0 59138 1 0 61139 1 0 61140 1 0 61141 1 0 62142 1 0 62143 1 0 62144 1 0 63145 1 0 63146 1 0 63147 1 0 M CHG 2 56 -1 60 1 M END