HMDB0288146 RDKit 3D PC(22:3(10Z,13Z,16Z)/20:4(6E,8Z,11Z,13E)-2OH(5S,15S)) 151150 0 0 0 0 0 0 0 0999 V2000 -5.9846 -5.1132 -4.6545 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3776 -4.6383 -4.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9729 -3.8992 -5.4506 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0954 -2.7259 -5.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -1.7709 -4.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0676 -0.5997 -5.0549 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9929 0.3100 -3.9038 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 0.6026 -3.3063 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5171 0.0509 -3.7133 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0473 -0.6726 -2.5033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9414 -0.3648 -1.8816 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0685 0.7324 -2.3451 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9806 1.7936 -1.3374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0816 2.2453 -0.7244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4047 1.7102 -0.9806 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 1.1894 0.3269 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3999 0.6625 -0.0663 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2432 0.1776 1.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5289 -0.3374 0.4975 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 -0.7082 1.4303 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5086 -1.7017 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3238 -3.1345 2.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1592 -3.7320 1.6831 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -5.0390 1.8199 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0641 -3.2385 1.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0787 -4.1938 0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -3.6350 -0.1265 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1701 -3.4903 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9313 -2.4173 -1.9441 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -2.3379 -3.6234 P 0 0 0 0 0 5 0 0 0 0 0 0 4.4187 -3.0706 -3.9927 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7849 -3.1229 -4.3004 O 0 0 0 0 0 1 0 0 0 0 0 0 3.1232 -0.7656 -4.1878 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6386 -0.6906 -5.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6266 0.7247 -6.0082 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9076 1.3603 -6.0247 N 0 0 0 0 0 4 0 0 0 0 0 0 4.1114 2.0284 -4.7522 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0118 0.4795 -6.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9324 2.4110 -7.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2453 -2.5983 0.5228 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0248 -2.6926 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6325 -3.8135 0.8889 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6838 -1.5609 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1017 -1.9040 2.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -0.7236 2.7459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1984 -1.1240 3.0824 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8764 -1.4805 1.8862 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9775 -0.2242 3.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8873 1.1162 3.9751 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7645 1.8567 4.8636 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7566 3.1373 5.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8235 4.0139 4.2609 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0439 4.7463 5.3205 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7626 4.7179 5.4694 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8872 3.9684 4.6241 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5729 3.9791 4.8292 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3554 3.2272 3.9866 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1317 1.9779 3.6793 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7004 3.0819 4.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 2.3383 5.9997 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6198 2.0573 6.8487 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4169 3.1735 7.3972 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0997 4.0506 6.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2729 -4.2530 -4.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6627 -5.8815 -3.9343 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9395 -5.4530 -5.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3971 -4.0435 -3.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0413 -5.5298 -4.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0118 -4.5502 -6.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9956 -3.5134 -5.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4816 -2.1961 -6.6853 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0758 -3.1077 -6.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9878 -1.4066 -4.3622 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5642 -2.2541 -3.7242 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 -0.0442 -5.8431 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1531 -1.0062 -5.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9449 0.7573 -3.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8594 1.2802 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5665 -0.6135 -4.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9549 0.9496 -3.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6697 -1.5144 -2.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6973 -0.9696 -1.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4187 1.1749 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0751 0.2637 -2.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9305 2.2714 -1.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0151 3.0642 0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3981 0.8486 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1212 2.4534 -1.4005 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4462 0.3426 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0635 1.9553 1.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 1.5537 -0.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3189 -0.0330 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7376 -0.5386 1.7357 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4845 1.0744 1.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3234 -1.1701 -0.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9397 0.4751 -0.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0049 0.2958 1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -0.9929 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5124 -1.6173 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8016 -1.4005 3.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4706 -3.6599 3.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2889 -3.5835 1.7546 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7544 -4.6829 1.5874 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6397 -4.9630 0.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1275 -4.5072 -0.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6603 -4.4344 -1.9742 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2017 -3.4067 -2.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5616 -1.0052 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1189 -1.4178 -6.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8969 1.2877 -5.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2026 0.7038 -7.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3233 2.8165 -4.5966 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1393 1.3064 -3.9407 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0874 2.5791 -4.7182 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8419 -0.2937 -7.0112 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9202 1.0465 -6.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2977 -0.0619 -5.3199 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9302 2.8598 -7.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2027 3.1913 -6.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6217 2.0578 -8.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6744 -0.6707 1.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0827 -1.3300 2.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0436 -2.7242 2.8501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6765 -2.3002 1.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7609 0.1777 2.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2142 -0.5082 3.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1098 -2.0992 3.6324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6171 -0.8582 1.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -0.6400 4.5716 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1349 1.5303 3.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5146 1.3168 5.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4818 3.6095 5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3732 4.7453 3.6204 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1194 3.4289 3.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6147 5.3670 6.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3198 5.2993 6.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2257 3.3741 3.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2002 4.5768 5.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5308 3.8348 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5388 1.4211 3.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0748 4.1328 4.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4296 2.5924 4.0565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6313 2.8811 6.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9712 1.3678 5.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3181 1.4056 6.2331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2481 1.4379 7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2325 2.7713 8.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 3.8130 8.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2469 3.5642 5.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6173 5.0500 6.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1725 4.2805 6.7329 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 2 0 11 12 1 0 12 13 1 0 13 14 2 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 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 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 2 0 30 32 1 0 30 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 36 38 1 0 36 39 1 0 27 40 1 0 40 41 1 0 41 42 2 0 41 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 46 48 1 0 48 49 2 0 49 50 1 0 50 51 2 0 51 52 1 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 57 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 1 64 1 0 1 65 1 0 1 66 1 0 2 67 1 0 2 68 1 0 3 69 1 0 3 70 1 0 4 71 1 0 4 72 1 0 5 73 1 0 5 74 1 0 6 75 1 0 6 76 1 0 7 77 1 0 8 78 1 0 9 79 1 0 9 80 1 0 10 81 1 0 11 82 1 0 12 83 1 0 12 84 1 0 13 85 1 0 14 86 1 0 15 87 1 0 15 88 1 0 16 89 1 0 16 90 1 0 17 91 1 0 17 92 1 0 18 93 1 0 18 94 1 0 19 95 1 0 19 96 1 0 20 97 1 0 20 98 1 0 21 99 1 0 21100 1 0 22101 1 0 22102 1 0 26103 1 0 26104 1 0 27105 1 6 28106 1 0 28107 1 0 34108 1 0 34109 1 0 35110 1 0 35111 1 0 37112 1 0 37113 1 0 37114 1 0 38115 1 0 38116 1 0 38117 1 0 39118 1 0 39119 1 0 39120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 45125 1 0 45126 1 0 46127 1 1 47128 1 0 48129 1 0 49130 1 0 50131 1 0 51132 1 0 52133 1 0 52134 1 0 53135 1 0 54136 1 0 55137 1 0 56138 1 0 57139 1 6 58140 1 0 59141 1 0 59142 1 0 60143 1 0 60144 1 0 61145 1 0 61146 1 0 62147 1 0 62148 1 0 63149 1 0 63150 1 0 63151 1 0 M CHG 2 32 -1 36 1 M END