HMDB0010086 RDKit 3D PIP2(18:1(9Z)/16:1(9Z)) 146146 0 0 0 0 0 0 0 0999 V2000 1.0305 4.4192 3.3829 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8096 5.1494 4.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5405 5.0652 5.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9241 3.6037 5.6057 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2776 3.6627 6.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9332 2.4553 6.7489 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1629 1.7723 7.7902 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9701 0.4866 7.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4165 -0.6192 7.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3715 -1.5714 6.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1778 -2.7291 5.9531 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5871 -3.9145 5.4309 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8392 -4.1391 4.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -3.9438 2.9396 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1227 -4.4029 1.6555 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1081 -3.9198 1.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -4.8058 0.3709 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6637 -2.7153 1.1305 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8482 -2.2137 0.5518 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8941 -1.9907 1.6445 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3093 -1.2858 2.6685 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -0.8603 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0126 -1.0559 4.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9392 -0.1511 4.7906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8706 0.6719 4.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0472 -0.0026 3.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 0.9401 2.6905 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 0.1610 1.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0811 1.0373 1.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7895 0.1551 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8882 0.8057 -0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 0.9618 -1.9251 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7965 0.4982 -2.7742 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2068 -0.5315 -3.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7886 -1.7256 -3.1384 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2149 -2.8127 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0563 -3.3245 -4.8573 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4332 -4.4256 -5.8113 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -3.9881 -6.8421 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9239 -2.8520 -7.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6038 -1.1220 -0.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7467 -0.5434 -0.9881 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0511 0.6608 -1.9993 P 0 0 0 0 0 5 0 0 0 0 0 0 1.3616 -0.1565 -3.1026 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8216 1.4883 -1.2156 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2251 1.5535 -2.6945 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2309 1.6608 -4.0483 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6218 2.9724 -4.5718 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2548 2.8962 -4.3171 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7942 2.9812 -6.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9845 3.9271 -6.6905 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2327 3.0400 -6.5088 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4503 2.3480 -7.7048 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9298 3.3914 -8.9433 P 0 0 0 0 0 5 0 0 0 0 0 0 3.7304 4.0377 -9.6128 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 2.5185 -10.1249 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9491 4.6057 -8.3799 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1122 2.5688 -5.3861 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2488 3.6038 -4.4717 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8106 4.1278 -4.2466 P 0 0 0 0 0 5 0 0 0 0 0 0 7.6695 2.9397 -3.9001 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8461 5.1764 -2.9209 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4106 4.9831 -5.5758 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4937 1.3318 -4.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 0.6771 -3.9355 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2021 5.1331 2.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1539 3.8078 3.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9839 3.8337 3.4378 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0899 6.2218 4.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6047 4.8192 5.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5707 5.6599 6.1927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3545 5.4230 4.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9446 3.0874 4.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1704 3.2565 6.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2936 4.4758 7.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9949 4.1189 5.4475 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9511 2.7683 7.1387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1527 1.7566 5.8866 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7004 2.4299 8.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3198 0.2092 8.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -0.2390 6.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1077 -1.3185 7.6498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -1.0333 5.7912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7537 -1.9219 7.3385 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8401 -3.0249 6.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9705 -2.3047 5.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9578 -4.4038 6.2939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4539 -4.7240 5.4532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3977 -5.1610 4.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0369 -3.4323 4.1777 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -2.8561 2.8904 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6488 -4.4762 3.1312 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1504 -5.5504 1.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9685 -4.1879 0.8861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2621 -3.0932 -0.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2883 -2.9885 1.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7538 -1.4641 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6253 0.5228 5.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5358 -0.8674 5.5382 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 1.5982 3.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2675 1.0860 5.0274 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5806 -0.2524 2.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4533 -0.9365 3.5583 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6799 1.7828 2.2037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7784 1.2746 3.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3406 -0.1405 0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4466 -0.6743 2.1797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6924 1.9543 0.6321 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7854 1.2405 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0446 -0.3783 -0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2779 -0.6482 0.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7203 1.1630 0.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7542 1.4568 -2.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8606 0.2344 -2.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5297 1.4153 -3.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9092 -0.0490 -4.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2906 -0.7417 -4.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6323 -1.3685 -2.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0343 -2.1257 -2.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9435 -2.3652 -4.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7018 -3.6185 -3.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3519 -3.8069 -4.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5859 -2.5016 -5.4028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5326 -4.7438 -6.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8032 -5.3256 -5.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6464 -4.8521 -7.5098 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4214 -3.6964 -6.4049 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8493 -2.6528 -7.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -3.0824 -8.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5124 -1.9316 -7.5186 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0156 -1.4766 -1.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9818 -0.3051 0.0311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.0630 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 0.9072 -4.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9887 3.8571 -4.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6989 3.3152 -5.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4177 1.9871 -6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5962 4.6275 -7.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4684 4.1263 -6.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 1.5649 -9.9186 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8855 4.3424 -8.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0909 2.2526 -5.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9244 5.3886 -2.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2227 5.9549 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3244 0.6262 -5.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1641 0.7432 -2.9751 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 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 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 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 19 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 43 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 54 57 1 0 52 58 1 0 58 59 1 0 59 60 1 0 60 61 2 0 60 62 1 0 60 63 1 0 58 64 1 0 64 65 1 0 64 47 1 0 1 66 1 0 1 67 1 0 1 68 1 0 2 69 1 0 2 70 1 0 3 71 1 0 3 72 1 0 4 73 1 0 4 74 1 0 5 75 1 0 5 76 1 0 6 77 1 0 6 78 1 0 7 79 1 0 8 80 1 0 9 81 1 0 9 82 1 0 10 83 1 0 10 84 1 0 11 85 1 0 11 86 1 0 12 87 1 0 12 88 1 0 13 89 1 0 13 90 1 0 14 91 1 0 14 92 1 0 15 93 1 0 15 94 1 0 19 95 1 6 20 96 1 0 20 97 1 0 24 98 1 0 24 99 1 0 25100 1 0 25101 1 0 26102 1 0 26103 1 0 27104 1 0 27105 1 0 28106 1 0 28107 1 0 29108 1 0 29109 1 0 30110 1 0 30111 1 0 31112 1 0 32113 1 0 33114 1 0 33115 1 0 34116 1 0 34117 1 0 35118 1 0 35119 1 0 36120 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 40130 1 0 41131 1 0 41132 1 0 45133 1 0 47134 1 6 48135 1 0 49136 1 0 50137 1 0 51138 1 0 52139 1 0 56140 1 0 57141 1 0 58142 1 6 62143 1 0 63144 1 0 64145 1 0 65146 1 0 M END