HMDB0288050 RDKit 3D PC(22:6(4Z,8Z,10Z,13Z,16Z,19Z)-OH(7)/22:2(13Z,16Z)) 151150 0 0 0 0 0 0 0 0999 V2000 -1.9315 10.6145 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6293 9.2360 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 9.3650 0.8966 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9492 9.0136 2.1137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2704 8.4063 2.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0362 7.0515 3.0534 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 5.9555 2.5565 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3335 5.8727 1.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6468 5.2346 1.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0496 4.1226 1.0435 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1675 3.4072 0.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8823 2.0295 0.5568 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1707 0.9728 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7972 1.0487 -1.4382 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0745 -0.0398 -2.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7225 -1.3706 -1.5842 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5681 -1.4911 -0.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0605 -2.5160 -2.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4256 -2.5090 -3.8094 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6612 -3.4709 -4.2565 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3181 -4.6964 -3.5222 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8226 -4.9012 -3.3985 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1123 -3.8129 -2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -2.8788 -2.2052 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2747 -3.7560 -2.6321 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9623 -2.7023 -1.9893 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4599 -2.9793 -2.1449 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3051 -2.0263 -1.3769 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6734 -2.3167 -1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5067 -1.1578 -0.4716 P 0 0 0 0 0 5 0 0 0 0 0 0 5.3326 0.1766 -1.1605 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1342 -1.5570 -0.4839 O 0 0 0 0 0 1 0 0 0 0 0 0 4.8465 -1.0579 1.0777 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 -2.2445 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5116 -2.2024 3.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9961 -1.1381 3.9534 N 0 0 0 0 0 4 0 0 0 0 0 0 6.4185 -1.0609 4.0707 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4197 0.1067 3.4675 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -1.3279 5.3091 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7492 -3.0228 -3.5428 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1113 -4.1588 -4.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1701 -5.1822 -3.3104 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4259 -4.5037 -5.5361 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9721 -3.7044 -6.5974 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4828 -2.5186 -7.2449 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4454 -1.1357 -6.8637 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8188 -0.6759 -5.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8113 0.8705 -5.5859 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 1.4288 -4.3326 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8492 0.9871 -4.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3239 1.6166 -2.7582 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 1.3587 -1.5958 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6797 1.9383 -0.2728 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5656 1.2283 0.0392 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7407 0.5206 1.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3018 0.3638 2.1493 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2705 0.8624 3.4248 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3626 0.1358 4.5034 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0982 -1.2601 4.5634 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1147 -2.1264 4.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1728 -1.9755 3.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3981 -2.8293 4.2231 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9677 -4.2986 4.3049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4354 10.4220 -1.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0131 11.2020 -1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6588 11.1577 -0.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0669 8.7112 -1.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5871 8.7713 -0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2825 9.8012 0.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1999 9.1373 2.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5696 9.0357 3.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0363 8.4483 1.7768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3956 7.0342 3.9824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 5.0080 3.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7458 5.5151 0.5242 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 6.9322 1.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2949 5.7732 2.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0178 3.7135 1.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1466 3.8988 0.1476 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5458 3.4479 -0.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4147 1.9133 1.5224 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9208 -0.0361 0.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0691 1.9696 -1.8845 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5403 -0.0175 -3.1182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7067 -1.3770 -1.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5008 -1.2773 -0.7046 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1843 -2.4890 -2.6541 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9088 -3.4355 -1.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6045 -1.6122 -4.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2221 -3.3849 -5.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8435 -4.8735 -2.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6465 -5.5462 -4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7058 -5.8051 -2.7256 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3566 -5.2000 -4.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6971 -2.6464 -0.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7558 -1.7643 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 -3.9936 -1.7046 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2499 -0.9841 -1.8247 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9896 -1.9131 -0.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6385 -3.0646 1.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2041 -2.4786 1.7901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4096 -2.0606 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6814 -3.2066 3.5995 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9494 -0.6728 3.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7835 -2.0868 4.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6426 -0.3942 4.9372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4191 -0.0857 3.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 0.8240 4.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1099 0.5876 2.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1779 -1.9663 5.9006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5324 -1.8791 5.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3903 -0.3704 5.8397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -4.9587 -5.9852 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0044 -5.5457 -5.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3128 -4.4867 -7.4155 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0965 -3.4058 -6.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3506 -2.7855 -7.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9001 -2.5591 -8.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5592 -0.7576 -6.8917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0331 -0.5355 -7.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4838 -0.9776 -4.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8142 -1.0515 -5.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8516 1.1852 -5.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1874 1.1855 -6.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.5372 -4.3963 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8857 1.1170 -3.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2179 1.4702 -4.8503 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6603 -0.0796 -4.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7023 1.2195 -2.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2281 2.7104 -2.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3117 0.2791 -1.4734 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1866 1.8803 -1.7427 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3412 2.9851 -0.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 1.9928 0.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3787 1.3237 -0.7147 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7331 0.0303 1.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7259 -0.6443 2.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1683 1.0393 1.9236 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6355 1.9203 3.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8141 0.6060 5.4245 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4912 -1.7051 3.6622 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8966 -1.3928 5.3424 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5218 -1.6629 5.8774 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8388 -3.1794 5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8054 -2.3447 2.9016 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4775 -0.9259 3.7197 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8561 -2.5416 5.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1225 -2.7803 3.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6804 -4.9602 3.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9369 -4.4263 3.8775 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 -4.5576 5.3879 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 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 2 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 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 1 0 57 58 2 0 58 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 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 7 74 1 0 8 75 1 0 8 76 1 0 9 77 1 0 10 78 1 0 11 79 1 0 11 80 1 0 12 81 1 0 13 82 1 0 14 83 1 0 15 84 1 0 16 85 1 0 17 86 1 0 18 87 1 0 18 88 1 0 19 89 1 0 20 90 1 0 21 91 1 0 21 92 1 0 22 93 1 0 22 94 1 0 26 95 1 0 26 96 1 0 27 97 1 1 28 98 1 0 28 99 1 0 34100 1 0 34101 1 0 35102 1 0 35103 1 0 37104 1 0 37105 1 0 37106 1 0 38107 1 0 38108 1 0 38109 1 0 39110 1 0 39111 1 0 39112 1 0 43113 1 0 43114 1 0 44115 1 0 44116 1 0 45117 1 0 45118 1 0 46119 1 0 46120 1 0 47121 1 0 47122 1 0 48123 1 0 48124 1 0 49125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 54135 1 0 55136 1 0 56137 1 0 56138 1 0 57139 1 0 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