HMDB0010097 RDKit 3D PIP2(18:1(9Z)/20:4(8Z,11Z,14Z,17Z)) 152152 0 0 0 0 0 0 0 0999 V2000 -1.9006 -1.7131 7.0349 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4404 -2.0996 7.3589 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0449 -1.1458 8.3216 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.3652 8.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8385 -0.3747 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2465 -0.7106 7.0763 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2116 0.0776 6.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0573 1.3863 6.1525 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7171 1.5167 4.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0806 1.8073 3.7503 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6509 2.0461 3.6712 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3209 3.4014 3.1232 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6294 4.2886 3.7837 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0502 4.2013 5.1126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4763 4.3568 4.9225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 3.1733 4.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4307 3.1932 3.8241 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8364 1.9461 3.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3192 1.8982 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6635 0.6251 2.0928 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0452 -0.3570 2.7745 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5734 0.4642 0.7273 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8907 -0.7969 0.1321 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6290 -1.3070 -0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6087 -1.3175 0.3599 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2999 -1.7225 0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1665 -2.0769 -1.1724 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1818 -1.7399 1.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0892 -3.0825 1.6659 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.2033 0.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2682 -5.5207 1.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4418 -6.7087 0.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5617 -6.7037 -0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9394 -6.4821 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9277 -6.5658 -1.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -5.6533 -1.4703 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 -4.2951 -0.9237 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4604 -3.2655 -1.9872 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5153 -1.8440 -1.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1637 -0.9110 -2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2264 0.5115 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3006 0.8950 -1.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4351 2.3717 -0.7875 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8179 2.7377 -0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9006 -0.5178 -0.9699 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2981 0.3478 -1.9003 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3219 0.6339 -3.2001 P 0 0 0 0 0 5 0 0 0 0 0 0 -7.6186 -0.0971 -2.9389 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6649 2.2743 -3.2249 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6892 0.0438 -4.6335 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1713 0.9891 -5.4975 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6578 1.0889 -5.3618 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4007 1.6580 -4.1166 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1434 2.0270 -6.4213 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7803 2.2615 -6.2586 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3653 1.4918 -7.8133 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1976 0.8227 -8.1773 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4216 1.5162 -9.5074 P 0 0 0 0 0 5 0 0 0 0 0 0 0.0252 1.0403 -9.4719 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0583 0.9898 -10.9818 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4073 3.1984 -9.3857 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4862 0.4757 -7.8566 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9526 -0.7879 -7.5515 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8984 -1.7952 -8.9255 P 0 0 0 0 0 5 0 0 0 0 0 0 -4.7773 -1.2713 -10.0416 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3038 -1.9002 -9.5029 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4895 -3.3179 -8.4903 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6184 0.8050 -6.9114 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2527 1.9392 -7.3797 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9326 -0.6900 6.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3061 -2.3951 6.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5423 -1.7697 7.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0276 -2.2228 6.4036 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5085 -3.1308 7.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5034 -1.0898 9.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4142 0.3623 8.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4657 -1.0254 6.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6595 0.6509 6.4438 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4213 -1.7144 7.5342 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2585 -0.2558 6.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1177 1.9071 6.1947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7286 2.0607 6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8099 1.3614 4.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6262 1.8921 2.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2254 1.3438 2.8738 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0332 1.8935 4.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6966 3.6286 2.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4609 5.2471 3.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3328 5.1122 5.7136 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1727 3.2793 5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6662 5.3022 4.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 4.4229 5.8915 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7523 2.2646 4.7352 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3379 3.0240 3.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 3.3528 4.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6164 4.0851 3.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2087 1.8588 2.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 1.0661 3.7477 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8801 2.0221 3.7087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5401 2.8037 2.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -1.5099 0.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4244 -0.6574 -1.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8736 -2.3127 -1.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4462 -0.9839 1.7977 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7753 -1.4477 0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0522 -3.3198 2.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6973 -3.1039 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0304 -3.9094 0.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 -4.2236 0.0306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6859 -5.6902 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0755 -5.5172 2.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 -7.5888 1.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4963 -6.9869 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6166 -7.6412 -1.0977 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4192 -5.8867 -1.2598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0817 -7.3414 0.8102 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0738 -5.5815 0.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9866 -7.5507 -1.5256 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4345 -5.8975 -2.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8116 -4.0228 -0.5399 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0975 -4.1433 -0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1317 -3.3956 -2.8681 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4172 -3.4455 -2.3622 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5388 -1.5782 -1.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8213 -1.6472 -0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9027 -1.0505 -3.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1451 -1.1438 -3.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2589 0.8228 -1.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9854 1.2154 -3.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2412 0.6997 -1.3652 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5369 0.3499 -0.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2035 3.0089 -1.6715 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7067 2.6572 -0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7980 3.7496 0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2454 2.0109 0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5384 2.8140 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2272 -1.4539 -1.4313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8114 -0.0166 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4832 2.6946 -2.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5273 1.9766 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1251 0.1525 -5.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8242 2.5530 -4.0181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6493 3.0147 -6.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5418 2.3168 -5.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5398 2.3069 -8.5333 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 0.6109 -10.8866 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4925 3.5385 -9.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 0.4293 -8.9164 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6386 -1.9022 -8.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0875 -3.5673 -7.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2941 -0.0856 -6.9083 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5216 1.8809 -8.3271 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 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 4 76 1 0 5 77 1 0 5 78 1 0 6 79 1 0 7 80 1 0 8 81 1 0 8 82 1 0 9 83 1 0 10 84 1 0 11 85 1 0 11 86 1 0 12 87 1 0 13 88 1 0 14 89 1 0 14 90 1 0 15 91 1 0 15 92 1 0 16 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 1 24102 1 0 24103 1 0 28104 1 0 28105 1 0 29106 1 0 29107 1 0 30108 1 0 30109 1 0 31110 1 0 31111 1 0 32112 1 0 32113 1 0 33114 1 0 33115 1 0 34116 1 0 34117 1 0 35118 1 0 36119 1 0 37120 1 0 37121 1 0 38122 1 0 38123 1 0 39124 1 0 39125 1 0 40126 1 0 40127 1 0 41128 1 0 41129 1 0 42130 1 0 42131 1 0 43132 1 0 43133 1 0 44134 1 0 44135 1 0 44136 1 0 45137 1 0 45138 1 0 49139 1 0 51140 1 1 52141 1 0 53142 1 0 54143 1 0 55144 1 0 56145 1 0 60146 1 0 61147 1 0 62148 1 6 66149 1 0 67150 1 0 68151 1 0 69152 1 0 M END