HMDB0286178 RDKit 3D PC(20:4(8Z,11Z,14Z,17Z)-2OH(5S,6R)/17:0) 139138 0 0 0 0 0 0 0 0999 V2000 6.2826 1.5698 -3.6898 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8596 2.6385 -2.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2472 2.3485 -2.4175 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7819 2.1267 -1.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9516 2.1519 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4265 3.2172 0.9154 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8567 2.9871 2.1214 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9434 1.6367 2.7487 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0956 1.5899 3.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1155 0.7577 4.1278 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6409 -0.2723 3.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3226 -0.2707 2.6612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3451 0.5745 2.6925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3375 1.8505 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1554 3.0166 2.4048 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1315 4.2520 3.0063 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9396 2.8581 1.5285 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8050 3.0283 2.2897 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9845 3.8606 0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7845 3.7338 -0.4729 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6724 2.3841 -1.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5274 2.3091 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1594 3.3285 -2.2409 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 1.1447 -2.6909 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8729 0.9993 -3.6051 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9144 -0.4697 -4.0806 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9652 -0.6888 -5.1305 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0342 -2.0184 -5.4879 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2113 -2.2384 -6.6622 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.5512 -1.9427 -8.0162 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4776 -1.1103 -6.5085 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.7711 -3.8077 -6.7394 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0403 -4.7159 -5.9765 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5727 -6.1072 -6.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8096 -7.0185 -5.2913 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.0775 -6.4076 -4.2013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8373 -7.7689 -6.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6634 -8.0509 -4.6857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1942 -1.2186 -2.9541 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3428 -2.1181 -2.3526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7964 -2.2723 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7874 -2.8835 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1038 -1.8590 -0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5936 -2.4711 1.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8315 -3.2926 1.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0122 -2.5939 0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4979 -1.4316 1.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6558 -0.8130 0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4712 0.2298 1.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8064 1.4686 1.7966 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9084 1.3454 2.9662 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3374 2.7678 3.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4342 2.6554 4.4099 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7588 3.8730 4.8861 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7481 4.5748 4.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1003 5.0946 2.7562 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8712 5.8775 2.2206 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2821 1.9042 -4.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9612 1.4414 -4.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1613 0.6297 -3.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8546 3.5819 -3.3843 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1528 2.7798 -1.9403 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9488 2.3089 -3.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.9145 -1.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8337 1.1646 0.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9239 2.4690 -0.2967 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4234 4.2749 0.5898 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1908 3.8368 2.7564 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0423 1.5644 3.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8327 0.8764 2.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3184 2.3189 4.7486 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6113 0.8442 5.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7593 -1.2950 3.7549 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4188 -0.3818 2.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1245 -1.2223 2.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4246 0.2656 2.1329 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3526 1.8728 3.9712 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0851 2.0669 4.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0636 3.0464 1.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0152 4.1875 3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9527 1.8500 1.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6027 2.2463 2.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0287 4.9245 0.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8723 3.7157 -0.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8608 3.9563 0.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8116 4.5004 -1.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5877 1.5596 -0.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5944 2.1680 -1.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8158 1.6729 -4.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8338 1.1984 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0838 -0.6931 -4.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9761 -0.3580 -4.7864 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7178 -0.0276 -6.0079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0536 -4.4311 -4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9996 -4.7032 -6.3534 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6722 -6.4384 -7.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6053 -6.0811 -5.6361 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -5.6966 -4.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5742 -7.1870 -3.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8121 -5.9256 -3.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0256 -7.1292 -6.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3205 -8.3813 -6.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3785 -8.5016 -5.3869 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9367 -8.7972 -5.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1053 -8.6078 -3.9093 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5531 -7.5965 -4.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0538 -3.5553 -0.7935 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6075 -3.5235 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1501 -1.3361 0.1632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -1.1131 -0.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7767 -3.0877 1.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7793 -1.6478 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -3.7064 2.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5917 -4.1768 0.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -2.1896 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8707 -3.2969 0.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6897 -1.7372 2.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5688 -0.7726 1.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3268 -1.6846 0.4109 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2642 -0.4658 -0.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1946 -0.1624 2.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2120 0.5695 0.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2185 1.8720 0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5724 2.2929 1.9357 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5668 1.1014 3.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0875 0.6662 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2667 3.3579 3.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9343 3.1044 2.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6454 1.8588 4.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0318 2.1891 5.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5777 4.6245 5.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2607 3.6113 5.8905 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3361 5.4497 4.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7985 3.9357 3.9912 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1392 4.2087 2.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9838 5.7048 2.7458 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 5.3333 2.5255 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8946 6.8795 2.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0125 5.9354 1.1215 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 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 35 38 1 0 26 39 1 0 39 40 1 0 40 41 2 0 40 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 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 13 76 1 0 14 77 1 0 14 78 1 0 15 79 1 6 16 80 1 0 17 81 1 6 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 21 87 1 0 21 88 1 0 25 89 1 0 25 90 1 0 26 91 1 6 27 92 1 0 27 93 1 0 33 94 1 0 33 95 1 0 34 96 1 0 34 97 1 0 36 98 1 0 36 99 1 0 36100 1 0 37101 1 0 37102 1 0 37103 1 0 38104 1 0 38105 1 0 38106 1 0 42107 1 0 42108 1 0 43109 1 0 43110 1 0 44111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 48119 1 0 48120 1 0 49121 1 0 49122 1 0 50123 1 0 50124 1 0 51125 1 0 51126 1 0 52127 1 0 52128 1 0 53129 1 0 53130 1 0 54131 1 0 54132 1 0 55133 1 0 55134 1 0 56135 1 0 56136 1 0 57137 1 0 57138 1 0 57139 1 0 M CHG 2 31 -1 35 1 M END