HMDB0010095 RDKit 3D PIP2(18:1(9Z)/20:3(8Z,11Z,14Z)) 154154 0 0 0 0 0 0 0 0999 V2000 4.6567 -5.5921 -2.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7396 -4.4995 -1.7902 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3005 -5.0468 -0.4728 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3693 -4.3090 0.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6503 -2.9650 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8129 -1.9090 -0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9883 -0.8792 -0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8635 -0.7379 0.8567 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4064 -0.7218 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2121 0.2827 0.1002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1068 1.5378 0.8691 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0339 2.6248 -0.1805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9327 3.5618 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1199 3.6972 0.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2162 5.0747 1.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 6.1751 0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3494 7.5530 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4827 8.3598 1.4104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1031 8.7043 0.9803 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1811 7.5843 0.9225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4342 6.4594 1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 7.6591 0.3197 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9226 6.5038 0.3526 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2606 6.7986 0.9719 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9853 5.5934 1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5945 4.5401 1.8766 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5291 4.7055 2.5566 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3408 3.2404 1.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5282 2.3484 2.8915 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1239 0.9831 3.0998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1859 0.1872 3.9917 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -1.2245 4.2279 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7189 -2.0110 5.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -3.4697 5.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0767 -4.0858 6.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3407 -5.0656 5.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4737 -5.6745 4.2945 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1804 -5.4632 3.5226 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0255 -6.0553 4.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2266 -5.7208 3.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5203 -6.2539 3.8426 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -5.8536 2.9052 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9851 -6.3403 3.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0889 -5.9194 2.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1994 6.0622 -1.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 5.7473 -1.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2215 5.2546 -3.3114 P 0 0 0 0 0 5 0 0 0 0 0 0 0.6568 6.3165 -4.2289 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8411 5.0368 -3.7326 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3219 3.8391 -3.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5056 3.3817 -4.8964 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2123 2.0652 -4.8732 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 2.1446 -3.9272 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3462 0.9015 -4.4992 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 1.0243 -3.1612 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9107 0.8354 -5.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6596 0.4289 -6.6328 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3741 -1.0768 -6.9036 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.0161 -1.1382 -8.2775 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1798 -2.3016 -6.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5485 -1.3951 -5.7399 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6229 2.1453 -5.2083 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8668 2.3107 -3.8278 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5259 2.4125 -3.5300 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.2217 1.7357 -4.7026 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8943 1.6269 -2.0734 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9747 4.0333 -3.5098 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7772 3.2875 -5.6436 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5687 3.3683 -7.0156 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5054 -5.6785 -1.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9926 -5.2185 -3.4321 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0696 -6.5130 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8788 -4.2904 -2.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4452 -3.6471 -1.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1888 -5.4623 0.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7663 -6.0306 -0.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4065 -4.1561 -0.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0305 -4.9719 1.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7102 -3.0539 1.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9335 -2.8082 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6544 -1.9547 -0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1571 -0.1110 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9822 0.2923 1.2909 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8022 -1.3932 1.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5898 -1.6211 -0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 0.2048 -0.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2121 1.5959 1.4886 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0249 1.6412 1.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1686 2.6398 -0.8683 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7544 4.2980 -1.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0343 3.6616 -0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2333 2.9662 1.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2609 5.0300 1.6225 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5436 5.0771 1.9877 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0548 5.9461 -0.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3103 6.0970 -0.5381 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4532 7.6451 0.9562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5177 8.1387 -0.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0187 9.3744 1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4454 8.0092 2.4907 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6403 9.4492 1.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2022 9.2079 -0.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4586 5.6617 0.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1188 7.2855 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8721 7.4550 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3497 3.3742 2.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3182 2.7681 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4007 2.8790 3.8633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4886 2.2543 2.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3391 0.4935 2.1492 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0854 1.1190 3.6538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1509 0.1866 3.5561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1079 0.7399 4.9509 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6127 -1.1147 4.8546 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9977 -1.7093 3.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6206 -1.6135 6.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7173 -2.0571 4.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3943 -3.9377 4.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0738 -3.4954 5.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8577 -3.7326 7.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5465 -5.5014 6.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3433 -5.4409 3.7018 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5268 -6.7959 4.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 -4.3798 3.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2452 -5.9044 2.5025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9468 -7.1440 4.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2271 -5.5957 5.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -6.1800 2.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3182 -4.6341 3.1454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -7.3614 3.8437 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7529 -5.8294 4.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4752 -6.2220 1.8777 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -4.7316 2.7904 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0055 -7.4355 3.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2541 -5.9386 4.3755 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0138 -5.6199 2.9724 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7812 -5.0418 1.8216 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3872 -6.7344 1.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7946 6.8001 -1.6525 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8037 5.1297 -1.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4335 4.9538 -2.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1763 4.1025 -5.4178 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7139 1.8354 -5.8507 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1346 1.5142 -3.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9637 -0.0067 -4.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5616 0.2016 -2.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5488 0.0521 -4.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4823 -3.0831 -6.3485 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7496 -2.3705 -5.6789 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5835 2.1626 -5.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7919 1.9170 -1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1454 4.3101 -4.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3516 4.2410 -5.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6637 2.5479 -7.5159 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 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 1 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 36121 1 0 37122 1 0 37123 1 0 38124 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