HMDB0010161 RDKit 3D PIP3(18:1(9Z)/20:3(8Z,11Z,14Z)) 159159 0 0 0 0 0 0 0 0999 V2000 1.1239 -1.5857 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4334 -2.1014 -0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3413 -2.4203 0.7093 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 -2.9236 0.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6079 -3.2267 1.3972 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7437 -1.9728 2.1671 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 -1.2934 2.3803 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2127 -1.5879 1.9075 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5851 -0.4917 0.9767 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1286 -0.6263 -0.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5854 -1.7402 -0.9733 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6034 -3.0733 -0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0547 -4.1258 -1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2913 -4.2352 -2.2401 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9876 -5.0098 -2.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2275 -5.0448 -3.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0607 -5.9357 -3.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9672 -5.7608 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -6.8716 -2.5862 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -6.9611 -1.7116 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -8.1459 -1.5687 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1512 -5.9965 -0.9621 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0281 -6.3831 -0.1537 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2562 -5.7811 -0.6445 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3609 -4.3944 -0.5053 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4518 -3.6807 -0.9766 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3444 -4.3527 -1.5754 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.2442 -0.8224 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7602 -1.6537 -1.6211 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9237 -0.1895 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9835 0.4997 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1311 1.9439 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1463 2.6641 -2.5603 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 4.1123 -2.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 4.8454 -2.0426 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8054 5.9467 -2.6877 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7877 6.6213 -3.5456 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0953 8.0165 -3.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8984 8.8984 -2.9046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1487 9.1623 -4.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9952 9.8539 -5.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2359 10.0960 -6.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1947 10.8197 -7.4446 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4197 9.9805 -7.6792 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1972 -5.9814 1.2882 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3317 -4.6266 1.4647 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5146 -4.1969 3.0660 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.3934 -4.9503 3.9935 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0993 -4.4366 3.6165 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2452 -2.5108 3.1731 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2085 -2.1348 4.4285 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5635 -1.0076 5.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1111 -0.5813 6.1931 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6679 0.1263 4.0636 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2884 1.2036 4.6852 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7785 1.5757 3.9527 P 0 0 0 0 0 5 0 0 0 0 0 0 2.9295 0.8048 2.6582 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8371 3.2115 3.5469 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0833 1.1743 4.9382 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6469 0.5199 3.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6219 0.4607 2.0728 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9054 1.9612 1.3484 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.2285 1.9520 0.6097 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 3.1637 2.5446 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2943 2.3538 0.2333 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8178 -0.2226 4.0527 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8758 -0.0538 3.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1596 0.7910 3.7865 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.0004 2.2715 3.5124 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1228 0.6021 5.4723 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6575 0.3190 3.1536 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -1.6767 4.2567 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2017 -2.4682 3.2621 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.6764 -0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3095 -2.3173 0.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3381 -1.1534 1.0531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9328 -1.3528 -1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2298 -2.9860 -1.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8727 -3.2414 1.2743 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4072 -1.4709 1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4808 -3.8996 -0.2557 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1098 -2.2017 -0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0826 -3.9589 2.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5472 -3.6970 1.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7963 -1.5711 2.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7391 -0.3565 2.9807 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8586 -1.5308 2.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1766 -2.5490 1.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3347 0.5204 1.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2761 0.4271 -0.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6486 -1.4369 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0228 -1.6661 -1.9641 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1664 -3.2212 0.5069 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1904 -5.0793 -0.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8697 -4.8683 -2.9591 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1023 -3.2866 -2.7564 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5152 -4.5499 -1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -6.0665 -1.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9404 -5.3949 -4.0775 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0098 -3.9878 -3.5647 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4629 -7.0014 -3.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -5.8743 -4.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5056 -4.7796 -2.3163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3647 -5.9835 -1.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6806 -6.8576 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -7.8226 -2.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1025 -7.4803 -0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3034 -5.9749 -1.7607 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1344 -6.3482 -0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6948 -1.7231 -1.1421 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7318 -2.0096 0.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5795 -1.8661 -2.6846 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -2.1857 -1.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9609 0.3357 -1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1088 -0.0158 -0.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8359 0.4405 -3.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9684 -0.0007 -1.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1494 2.4554 -1.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4136 2.0364 -0.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1361 2.1843 -2.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0225 2.6038 -3.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5975 3.9585 -0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1696 4.5496 -2.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 4.4337 -1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7963 6.4243 -2.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4128 6.6662 -4.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7493 6.1009 -3.6018 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8957 8.5060 -3.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5351 7.8792 -2.0155 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2779 9.8870 -2.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1889 8.5527 -2.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3301 9.8978 -3.9048 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6254 8.2730 -4.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9427 9.3555 -5.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2641 10.8841 -4.8101 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3297 10.7122 -6.3397 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8949 9.1323 -6.9243 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5011 11.7831 -6.9492 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6706 11.1022 -8.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6965 9.9894 -8.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2581 10.3642 -7.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1927 8.9434 -7.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1321 -6.4513 1.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6344 -6.3696 1.9113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1414 -4.3998 4.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2439 -3.0352 5.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5698 -1.3571 5.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5323 -0.1903 6.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3438 -0.1915 3.2447 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0611 3.3546 2.5954 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8316 1.7975 4.7183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8223 1.5910 3.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9716 4.0678 2.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 2.1498 -0.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1642 0.2969 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0001 0.2731 5.8196 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -0.0388 3.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1752 -1.9412 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5764 -3.2788 3.6605 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 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 2 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 23 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 56 58 1 0 56 59 1 0 54 60 1 0 60 61 1 0 61 62 1 0 62 63 2 0 62 64 1 0 62 65 1 0 60 66 1 0 66 67 1 0 67 68 1 0 68 69 2 0 68 70 1 0 68 71 1 0 66 72 1 0 72 73 1 0 72 51 1 0 1 74 1 0 1 75 1 0 1 76 1 0 2 77 1 0 2 78 1 0 3 79 1 0 3 80 1 0 4 81 1 0 4 82 1 0 5 83 1 0 5 84 1 0 6 85 1 0 7 86 1 0 8 87 1 0 8 88 1 0 9 89 1 0 10 90 1 0 11 91 1 0 11 92 1 0 12 93 1 0 13 94 1 0 14 95 1 0 14 96 1 0 15 97 1 0 15 98 1 0 16 99 1 0 16100 1 0 17101 1 0 17102 1 0 18103 1 0 18104 1 0 19105 1 0 19106 1 0 23107 1 1 24108 1 0 24109 1 0 28110 1 0 28111 1 0 29112 1 0 29113 1 0 30114 1 0 30115 1 0 31116 1 0 31117 1 0 32118 1 0 32119 1 0 33120 1 0 33121 1 0 34122 1 0 34123 1 0 35124 1 0 36125 1 0 37126 1 0 37127 1 0 38128 1 0 38129 1 0 39130 1 0 39131 1 0 40132 1 0 40133 1 0 41134 1 0 41135 1 0 42136 1 0 42137 1 0 43138 1 0 43139 1 0 44140 1 0 44141 1 0 44142 1 0 45143 1 0 45144 1 0 49145 1 0 51146 1 1 52147 1 0 53148 1 0 54149 1 0 58150 1 0 59151 1 0 60152 1 0 64153 1 0 65154 1 0 66155 1 1 70156 1 0 71157 1 0 72158 1 0 73159 1 0 M END