HMDB0010082 RDKit 3D PIP2(18:1(11Z)/20:3(8Z,11Z,14Z)) 154154 0 0 0 0 0 0 0 0999 V2000 9.3498 3.1919 -1.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5377 2.5242 0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1942 2.0617 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4576 1.4199 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1315 0.9333 2.5996 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3205 0.3088 3.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0008 -0.9258 4.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4153 -1.8345 3.1626 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -2.3338 3.5958 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9641 -2.1690 2.9671 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -1.4184 1.6747 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3528 -2.3583 0.6636 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2623 -2.2012 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3002 -1.1557 0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3215 0.0527 0.8252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0057 0.8339 0.3922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 2.0845 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1936 3.0170 0.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5857 2.6037 1.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1429 1.5763 0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5685 1.0532 -0.7841 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4678 1.1002 0.3948 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0321 0.1167 -0.4100 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2299 0.4955 -1.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0545 1.5020 -2.1467 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7646 2.8020 -1.9324 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6361 3.2299 -0.7649 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5837 3.7865 -3.0441 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4838 3.0875 -4.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2622 2.1582 -4.4509 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2826 1.4985 -5.7827 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0844 0.5527 -6.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1154 -0.4763 -4.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1301 -1.5685 -4.9195 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1086 -2.5537 -5.9792 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -2.3841 -7.3706 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3224 -2.0843 -7.6138 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2797 -1.1632 -8.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3838 -0.0947 -9.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1537 1.2633 -8.7696 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1563 1.8803 -7.4363 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8893 1.1610 -6.3453 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 2.0268 -5.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5062 1.3619 -3.9359 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2639 -1.1740 0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0807 -1.6834 0.8652 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3218 -3.1164 1.7229 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.3756 -4.1766 1.2071 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9094 -3.6744 1.5688 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9755 -2.8486 3.3672 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1258 -1.7812 3.5217 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8231 -0.6824 4.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1554 -0.6473 3.8092 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8842 -0.8737 5.7474 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9389 0.4184 6.3209 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6435 -1.5278 6.3138 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.9110 6.3619 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7873 -3.4618 7.9406 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.2238 -2.3842 8.8283 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3114 -3.8831 8.5588 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8066 -4.8376 7.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5196 -1.2803 5.3230 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2757 -1.5108 5.8584 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6697 -0.1116 5.8004 P 0 0 0 0 0 5 0 0 0 0 0 0 0.9649 0.4221 7.1849 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1771 1.0551 4.9211 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0955 -0.4289 4.9512 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -2.1690 4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8803 -3.5093 4.5448 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2915 3.1402 -1.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7318 4.2460 -1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9178 2.6580 -2.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9321 3.2456 0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1857 1.6535 0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4834 2.9098 0.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7443 1.3257 -0.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1150 0.5374 1.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9726 2.1075 2.6912 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5576 0.4018 1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5633 1.8963 2.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7626 0.9568 4.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1744 -1.3150 5.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5477 -1.5765 2.1261 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0827 -2.7894 3.2548 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0459 -2.9054 4.5419 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0378 -2.5799 3.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9253 -1.2029 1.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.5439 1.8687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9916 -3.2891 0.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0789 -3.0864 -0.7351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2172 -1.6079 0.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2156 -0.7884 -1.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0936 0.8101 0.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1118 -0.0914 1.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7606 0.0946 0.7292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1049 0.9904 -0.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0849 1.8990 2.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9266 2.6139 1.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9623 3.9779 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0912 3.3808 -0.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2271 3.5309 0.8549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7931 2.3688 2.1348 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2382 -0.1725 -1.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0672 0.7088 -0.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5361 -0.4347 -1.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3916 4.5162 -3.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6292 4.3103 -2.8671 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4104 2.5508 -4.6536 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3349 3.8812 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2937 1.5018 -3.5818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3674 2.8193 -4.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1789 0.8485 -5.8661 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2402 2.2577 -6.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1967 1.2185 -5.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 0.2115 -7.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1707 -0.9155 -4.9264 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 0.0836 -3.9622 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1096 -1.1003 -4.7272 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2936 -2.1263 -3.9334 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1538 -3.1036 -6.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4829 -3.4854 -5.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -3.4092 -7.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4149 -1.7197 -7.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3752 -2.8204 -7.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3952 -1.1683 -8.3035 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4904 -0.0506 -8.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 -0.3290 -10.1306 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2162 1.3527 -9.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3958 1.9963 -9.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7477 2.8929 -7.5305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8543 2.1659 -7.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5278 0.1457 -6.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9697 1.0513 -6.6365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1919 3.0318 -5.3213 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2691 2.1626 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3863 2.0189 -3.6911 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8883 1.3631 -3.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8943 0.3592 -4.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9342 -0.9445 1.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7295 -1.9294 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9202 -4.5092 1.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -1.3749 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3878 0.2915 3.9806 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6023 0.1901 4.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8034 -1.4080 6.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3207 1.0392 5.8666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4132 -1.1168 7.3108 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9217 -3.0893 8.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8609 -5.2209 8.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6165 -0.2290 4.9805 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4189 1.8495 4.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8533 -0.2436 5.5567 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9437 -2.0150 3.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9841 -3.8524 4.7400 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 1 0 36 37 1 0 37 38 2 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 54 56 1 0 56 57 1 0 57 58 1 0 58 59 2 0 58 60 1 0 58 61 1 0 56 62 1 0 62 63 1 0 63 64 1 0 64 65 2 0 64 66 1 0 64 67 1 0 62 68 1 0 68 69 1 0 68 51 1 0 1 70 1 0 1 71 1 0 1 72 1 0 2 73 1 0 2 74 1 0 3 75 1 0 3 76 1 0 4 77 1 0 4 78 1 0 5 79 1 0 5 80 1 0 6 81 1 0 7 82 1 0 8 83 1 0 8 84 1 0 9 85 1 0 10 86 1 0 11 87 1 0 11 88 1 0 12 89 1 0 13 90 1 0 14 91 1 0 14 92 1 0 15 93 1 0 15 94 1 0 16 95 1 0 16 96 1 0 17 97 1 0 17 98 1 0 18 99 1 0 18100 1 0 19101 1 0 19102 1 0 23103 1 6 24104 1 0 24105 1 0 28106 1 0 28107 1 0 29108 1 0 29109 1 0 30110 1 0 30111 1 0 31112 1 0 31113 1 0 32114 1 0 32115 1 0 33116 1 0 33117 1 0 34118 1 0 34119 1 0 35120 1 0 35121 1 0 36122 1 0 36123 1 0 37124 1 0 38125 1 0 39126 1 0 39127 1 0 40128 1 0 40129 1 0 41130 1 0 41131 1 0 42132 1 0 42133 1 0 43134 1 0 43135 1 0 44136 1 0 44137 1 0 44138 1 0 45139 1 0 45140 1 0 49141 1 0 51142 1 6 52143 1 0 53144 1 0 54145 1 0 55146 1 0 56147 1 0 60148 1 0 61149 1 0 62150 1 6 66151 1 0 67152 1 0 68153 1 0 69154 1 0 M END