HMDB0010133 RDKit 3D PIP2(20:4(5Z,8Z,11Z,14Z)/18:0) 154154 0 0 0 0 0 0 0 0999 V2000 -3.4296 0.2910 2.6828 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4734 1.4218 3.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7224 2.6365 3.1845 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2896 2.2244 2.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4572 3.3988 2.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4474 4.4602 3.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8697 5.6711 3.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4614 6.1839 2.0435 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6474 7.3257 1.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0617 7.3234 0.3998 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 6.2103 -0.5651 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2908 5.7976 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7806 5.8326 -2.0366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0876 6.2456 -3.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1027 5.0622 -4.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0182 4.4808 -4.5834 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3469 4.9033 -4.2169 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1748 5.2396 -5.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3763 4.0866 -6.3757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1075 2.9557 -5.7978 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5518 2.9912 -4.6284 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3424 1.7992 -6.5085 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9864 0.6530 -6.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3137 -0.2016 -5.0781 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0785 -1.4939 -4.9202 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4172 -2.4084 -4.1512 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -3.8369 -4.0571 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.2144 -3.7854 -2.8272 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -3.9386 -5.4662 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3227 -5.1620 -4.0333 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0301 -5.5271 -2.6944 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2140 -6.9900 -2.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5615 -7.1931 -2.1723 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3527 -7.7082 -1.5989 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0606 -7.8693 -0.3925 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0151 -7.0630 -1.3511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1702 -6.2242 -0.2555 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0478 -6.4313 0.9533 P 0 0 0 0 0 5 0 0 0 0 0 0 0.1719 -5.1358 1.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6636 -7.5520 2.0597 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4656 -6.9766 0.3927 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6938 -6.1815 -2.5598 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9775 -6.8162 -3.7423 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2581 -6.8656 -4.8559 P 0 0 0 0 0 5 0 0 0 0 0 0 0.3913 -5.5155 -5.5047 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1897 -7.9607 -6.0909 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7125 -7.4134 -4.2187 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6392 -5.0048 -2.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5597 -4.3629 -1.2109 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0451 0.4440 -3.8915 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 0.7483 -3.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8576 0.3834 -4.2509 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6053 1.4254 -2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3188 1.8424 -1.6485 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7539 0.9263 -1.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2705 -0.0003 -2.2311 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 -0.8718 -1.7867 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6254 -0.0050 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8209 -0.8300 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5896 -1.6158 0.1242 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3538 -0.6683 1.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1517 -1.3815 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3533 -2.2222 2.9744 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0805 -2.8770 4.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8626 -1.8694 5.4277 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -1.0457 5.6578 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9688 -0.0618 6.7466 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0105 1.0682 6.6641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5684 0.7067 6.6245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5095 -0.3314 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3616 0.6434 1.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 -0.4074 2.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1211 1.1060 4.6793 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5559 1.7234 3.8087 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7718 3.4548 3.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1901 2.9551 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8884 1.8173 3.8985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2887 1.4547 2.1425 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5916 3.0376 2.1972 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8637 3.7217 1.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0242 4.1856 4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7938 6.3673 4.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4923 6.6115 2.3428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7239 5.4316 1.3097 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5346 8.2241 2.2272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5305 8.2031 0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7197 5.3440 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5347 6.6379 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9185 5.4604 0.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8434 5.5048 -2.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1592 6.7643 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8436 6.9597 -3.7882 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1121 4.7072 -4.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1382 3.6049 -5.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8534 4.0199 -3.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4018 5.6924 -3.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1682 5.6269 -5.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6382 6.0456 -5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4142 3.7370 -6.8194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9654 4.4952 -7.2422 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0696 -0.0090 -7.0321 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0552 0.8286 -5.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3145 -0.4706 -5.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1651 -1.9181 -5.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1375 -1.3007 -4.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1363 -4.7507 -5.9831 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7234 -4.9274 -2.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1779 -7.5299 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8387 -8.1347 -2.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1583 -8.7343 -1.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5215 -8.4751 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1937 -7.7521 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6808 -7.2103 2.9929 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1551 -6.5814 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3621 -5.8370 -2.5567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 -8.3053 -6.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3554 -6.6503 -4.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3686 -4.2143 -3.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4373 -3.9344 -1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0618 0.6827 -1.3987 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3454 2.2951 -2.1616 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5285 2.5840 -0.7696 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1299 2.6255 -2.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3093 0.3333 -0.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5935 1.5060 -0.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5089 0.5122 -3.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4784 -0.7723 -2.4531 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7093 -1.5432 -2.6271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0726 -1.4318 -0.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8797 0.5402 -2.4487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3611 0.7277 -0.7132 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7413 -0.1822 -1.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0945 -1.5544 -1.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4276 -2.3223 0.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6662 -2.2363 -0.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1472 0.0887 1.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3915 -0.1283 1.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2224 -1.9709 2.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0332 -0.6071 3.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2132 -1.5117 2.9841 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5973 -3.0029 2.2423 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1371 -3.4505 4.2086 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8689 -3.6156 4.5826 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7095 -2.5197 6.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9286 -1.3701 5.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9718 -1.7122 5.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3988 -0.5057 4.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0012 0.4029 6.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8193 -0.5903 7.7606 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1672 1.7874 7.5387 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2839 1.7543 5.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0238 1.5135 7.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 0.7286 5.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3598 -0.2376 7.1437 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 2 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 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 38 41 1 0 36 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 44 47 1 0 42 48 1 0 48 49 1 0 24 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 64 65 1 0 65 66 1 0 66 67 1 0 67 68 1 0 68 69 1 0 48 31 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 16 94 1 0 17 95 1 0 17 96 1 0 18 97 1 0 18 98 1 0 19 99 1 0 19100 1 0 23101 1 0 23102 1 0 24103 1 6 25104 1 0 25105 1 0 29106 1 0 31107 1 1 32108 1 0 33109 1 0 34110 1 0 35111 1 0 36112 1 0 40113 1 0 41114 1 0 42115 1 6 46116 1 0 47117 1 0 48118 1 0 49119 1 0 53120 1 0 53121 1 0 54122 1 0 54123 1 0 55124 1 0 55125 1 0 56126 1 0 56127 1 0 57128 1 0 57129 1 0 58130 1 0 58131 1 0 59132 1 0 59133 1 0 60134 1 0 60135 1 0 61136 1 0 61137 1 0 62138 1 0 62139 1 0 63140 1 0 63141 1 0 64142 1 0 64143 1 0 65144 1 0 65145 1 0 66146 1 0 66147 1 0 67148 1 0 67149 1 0 68150 1 0 68151 1 0 69152 1 0 69153 1 0 69154 1 0 M END