HMDB0286064 RDKit 3D PC(20:5(5Z,8Z,10E,14Z,17Z)-OH(12)/16:1(9Z)) 131130 0 0 0 0 0 0 0 0999 V2000 5.8434 3.6470 3.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1637 2.8395 1.7829 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9806 2.7277 0.9265 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3681 1.6269 0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8257 0.2954 0.9499 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -0.5752 -0.1839 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5758 -1.7126 -0.4282 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4905 -2.2169 0.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8409 -3.5770 1.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0765 -4.4890 0.0421 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7266 -3.9048 1.9472 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6174 -4.5164 1.5871 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5481 -4.8126 2.5263 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5554 -5.4108 2.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8642 -5.8811 0.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0615 -5.1415 0.3587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0793 -4.3831 -0.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9382 -4.1684 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4971 -2.7339 -1.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6285 -1.8750 -2.1961 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2185 -0.4670 -2.3783 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9928 -0.0605 -3.5774 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 0.4737 -1.3795 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6705 1.7902 -1.7414 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7615 2.5391 -2.4927 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1297 3.7157 -3.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6761 4.6596 -2.2511 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0393 5.9805 -3.0266 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.9265 6.4231 -4.1083 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2116 7.2644 -1.9543 O 0 0 0 0 0 1 0 0 0 0 0 0 1.4828 5.5655 -3.7926 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4835 5.1865 -2.9264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 4.8381 -3.6925 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5726 3.7629 -4.6284 N 0 0 0 0 0 4 0 0 0 0 0 0 4.8342 3.6668 -5.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5501 4.0461 -5.6303 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3514 2.4922 -3.9912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8761 2.8086 -1.7087 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1027 2.1879 -1.7942 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2218 1.2537 -2.6598 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2673 2.5268 -0.9682 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0929 1.4237 -0.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4952 0.5191 0.5804 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2746 -0.1686 0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7002 -1.1086 1.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3339 -0.3773 2.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3057 0.7082 2.1923 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 1.3649 3.4862 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8322 1.4232 4.0472 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 0.8441 3.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0252 -0.2009 4.3667 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1464 -1.3620 4.6638 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8043 -2.3913 5.5488 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.8508 6.8896 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8697 -2.9757 7.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7531 4.1463 3.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0509 4.3750 2.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5287 2.9218 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6623 1.9394 2.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9242 3.4885 1.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5559 3.6965 0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4905 1.7265 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7968 0.4225 1.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1395 -0.1137 1.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9982 -0.2582 -0.8627 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8879 -2.3331 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6068 -2.4408 -0.2963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0967 -1.5664 1.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7948 -3.4145 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9294 -4.1194 -0.8588 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7918 -3.6323 3.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5393 -4.7880 0.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -4.5096 3.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -5.5865 2.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2399 -6.9464 0.9846 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0132 -5.8907 0.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9951 -5.2187 0.9279 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0155 -3.8560 -0.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3044 -4.4136 -2.6405 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0851 -4.8610 -1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3732 -2.6866 -2.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2494 -2.3256 -0.6715 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8666 -2.2890 -3.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5223 -1.9873 -1.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3967 2.3079 -0.7992 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2244 1.8058 -2.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1232 1.8022 -3.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2339 3.3756 -3.7282 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 4.1649 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 6.0086 -2.2213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1058 4.3715 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1014 5.7182 -4.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5677 4.5596 -3.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 2.7258 -5.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7022 3.6163 -4.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9212 4.5194 -6.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5032 5.1147 -5.8612 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5716 3.6991 -5.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8068 3.5352 -6.5985 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 1.8855 -4.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 1.8658 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0031 2.6702 -2.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9957 3.2241 -0.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9617 3.1738 -1.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4897 0.7770 -1.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0463 1.8262 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2722 -0.2792 0.8217 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3684 1.0292 1.5738 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4915 -0.7774 -0.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4636 0.5588 -0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4944 -1.8374 1.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8484 -1.6226 0.7401 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2426 0.0071 2.9188 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8773 -1.1185 3.1208 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6686 1.4639 1.4639 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3889 0.2914 1.7642 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 1.8583 4.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7783 1.9584 5.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1504 1.7045 3.5087 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 0.5851 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3241 0.3003 5.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9613 -0.5132 3.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8221 -1.1116 5.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0815 -1.8988 3.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0687 -3.2098 5.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6643 -2.8268 5.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9421 -1.0282 6.7197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3442 -1.5357 7.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -3.3330 7.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0768 -2.5349 8.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0909 -3.7517 7.8744 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 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 34 37 1 0 25 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 10 70 1 0 11 71 1 0 12 72 1 0 13 73 1 0 14 74 1 0 15 75 1 0 15 76 1 0 16 77 1 0 17 78 1 0 18 79 1 0 18 80 1 0 19 81 1 0 19 82 1 0 20 83 1 0 20 84 1 0 24 85 1 0 24 86 1 0 25 87 1 6 26 88 1 0 26 89 1 0 32 90 1 0 32 91 1 0 33 92 1 0 33 93 1 0 35 94 1 0 35 95 1 0 35 96 1 0 36 97 1 0 36 98 1 0 36 99 1 0 37100 1 0 37101 1 0 37102 1 0 41103 1 0 41104 1 0 42105 1 0 42106 1 0 43107 1 0 43108 1 0 44109 1 0 44110 1 0 45111 1 0 45112 1 0 46113 1 0 46114 1 0 47115 1 0 47116 1 0 48117 1 0 49118 1 0 50119 1 0 50120 1 0 51121 1 0 51122 1 0 52123 1 0 52124 1 0 53125 1 0 53126 1 0 54127 1 0 54128 1 0 55129 1 0 55130 1 0 55131 1 0 M CHG 2 30 -1 34 1 M END