HMDB0262336 RDKit 3D PE(20:4(5Z,8Z,11Z,14Z)/20:3(5Z,8Z,14Z)-O(11S,12R)) 130130 0 0 0 0 0 0 0 0999 V2000 -11.3558 6.6854 -1.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0115 5.9793 -1.7855 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3246 4.7644 -0.9159 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8937 5.2330 0.3941 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2393 4.0373 1.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1093 3.1705 1.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0421 1.9122 1.2348 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1276 1.2301 0.4469 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6900 0.1424 1.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7889 -1.1144 0.9587 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3459 -1.7895 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7513 -1.1382 -1.3583 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5661 -1.2959 -1.8705 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4611 -2.1638 -1.5201 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5427 -3.1464 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8462 -3.2069 0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8032 -2.2571 0.9957 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4632 -2.9414 1.1715 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3876 -1.9772 1.6008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0857 -2.6999 1.7996 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0841 -3.9312 1.4981 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9468 -2.1432 2.2708 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7165 -2.6881 2.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1122 -2.9670 1.2593 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4874 -3.8130 0.2184 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5288 -3.9916 -0.7798 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1314 -4.9525 -1.9823 P 0 0 0 0 0 5 0 0 0 0 0 0 0.4243 -4.5696 -3.3552 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7962 -4.5989 -2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0393 -6.5938 -1.7337 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1203 -6.8382 -0.9062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1916 -8.3607 -0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0688 -8.7518 -0.1552 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3106 -3.6257 1.7127 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -2.9591 1.7142 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 -1.7853 1.3289 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6817 -3.6922 2.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9115 -2.8704 2.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -2.3432 0.9036 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6477 -1.5986 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8259 -0.3498 0.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 0.5460 0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 1.0535 -1.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6096 2.3146 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2811 3.4072 -0.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3082 4.2826 0.1763 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2018 5.0422 -0.6973 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6892 4.2217 0.3848 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7724 3.2812 0.0254 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0809 3.0533 -1.3748 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2858 3.3468 -1.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4041 3.9116 -1.0807 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5448 2.9021 -1.1555 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7479 3.3391 -0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2714 4.6428 -0.9271 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5183 5.0360 -0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1346 5.9190 -2.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6124 7.2608 -1.0894 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3345 7.3644 -2.8646 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6326 5.5940 -2.7494 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2996 6.6617 -1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3895 4.1798 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0240 4.1144 -1.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8960 5.7016 0.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2114 5.9173 0.8986 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5761 4.4673 2.2835 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0882 3.5315 0.8665 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2543 3.6173 2.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1656 1.3405 1.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7154 0.9974 -0.5547 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9280 1.9538 0.2525 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1003 0.4840 2.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2849 -1.7856 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3281 -2.3527 -0.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7862 -2.7090 0.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4077 -0.4239 -1.9321 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3375 -0.6225 -2.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5404 -1.5363 -1.3289 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1517 -2.6574 -2.5262 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2515 -4.0003 -0.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0367 -4.0438 1.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6923 -1.3501 0.4289 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0799 -1.9195 2.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2065 -3.4516 0.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5098 -3.7413 1.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2724 -1.1746 0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6757 -1.4672 2.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0952 -2.0061 3.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7737 -3.6258 3.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4402 -1.9527 0.8928 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6965 -4.8197 0.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3462 -3.3346 -0.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2212 -5.3976 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9947 -6.4444 0.1139 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0804 -6.4469 -1.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -8.8044 -1.7553 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0583 -8.6671 -0.1482 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 -9.3426 0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7803 -8.0150 -0.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -4.5910 1.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4126 -4.0938 3.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8013 -2.0322 2.9776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7457 -3.4996 2.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6362 -1.8300 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6379 -3.2728 0.2811 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4928 -2.1437 1.6082 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7832 0.1718 1.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8799 0.0199 -0.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5505 1.2995 0.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6861 0.2867 -1.7378 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0492 2.5321 -2.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5464 4.1239 -0.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5678 3.0535 0.4126 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7729 5.1322 0.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0955 4.9823 1.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3790 2.2517 0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6778 3.3848 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3181 2.6239 -2.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4544 3.1511 -2.9172 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7848 4.8572 -1.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2372 4.1295 -0.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8836 2.7741 -2.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1922 1.8873 -0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4097 3.5035 0.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5150 2.5370 -0.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6467 4.5144 -1.9634 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5281 5.4525 -0.8678 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2798 4.8854 0.9592 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3322 4.3963 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6710 6.1202 -0.3459 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 24 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 43 44 2 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 2 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 48 46 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 16 81 1 0 17 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 23 88 1 0 23 89 1 0 24 90 1 6 25 91 1 0 25 92 1 0 29 93 1 0 31 94 1 0 31 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 37100 1 0 37101 1 0 38102 1 0 38103 1 0 39104 1 0 39105 1 0 40106 1 0 41107 1 0 42108 1 0 42109 1 0 43110 1 0 44111 1 0 45112 1 0 45113 1 0 46114 1 0 48115 1 0 49116 1 0 49117 1 0 50118 1 0 51119 1 0 52120 1 0 52121 1 0 53122 1 0 53123 1 0 54124 1 0 54125 1 0 55126 1 0 55127 1 0 56128 1 0 56129 1 0 56130 1 0 M END