HMDB0262292 RDKit 3D PE(20:3(8Z,11Z,14Z)/18:1(9Z)-O(12,13)) 130130 0 0 0 0 0 0 0 0999 V2000 16.1211 -3.9366 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6199 -4.0483 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0386 -2.8443 1.8207 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5093 -2.9744 1.8834 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9903 -1.7383 2.6006 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5435 -1.6775 2.7548 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7286 -0.7757 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3403 0.3323 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1310 1.6371 2.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5837 2.6703 1.5434 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0117 2.8749 0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 1.8877 -0.7989 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9837 1.3465 -1.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5267 1.5244 -1.3005 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9513 2.4932 -0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3868 2.5698 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9682 2.9077 -1.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 3.2452 -2.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4188 2.4453 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 2.1726 -0.5874 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6161 2.4305 0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3183 1.6171 -0.4465 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8297 1.3583 0.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2784 0.8736 0.7424 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4213 -0.4928 0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6405 -1.4370 0.8323 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8843 -2.9506 0.1251 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.1910 -3.5652 0.5793 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6369 -3.9690 0.6845 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7909 -2.8244 -1.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9346 -4.0261 -2.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8539 -3.8505 -3.6875 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -3.2872 -4.0477 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 1.8512 0.0874 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0764 2.5554 0.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3899 2.3163 1.8506 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 3.5799 -0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 3.4363 -1.6127 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8814 2.4214 -2.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8766 0.9676 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8288 0.4269 -1.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 0.8212 -1.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3169 0.3062 -0.7189 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5968 0.7993 -1.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4051 1.5760 -0.6509 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2088 2.0810 0.7194 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4047 1.7326 1.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3385 2.1667 2.8742 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6424 0.7558 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7256 -0.1990 3.1985 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0428 -1.1954 2.3266 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0131 -2.0652 1.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9453 -2.8502 2.4393 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2173 -3.7881 3.3774 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3882 -2.9474 0.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5319 -4.7006 0.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6194 -4.0253 2.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2953 -5.0055 1.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2421 -4.0022 0.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4776 -2.7667 2.8341 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3348 -1.9451 1.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1570 -2.9926 0.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2838 -3.9022 2.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3924 -1.8964 3.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5466 -0.8910 2.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0784 -2.4777 3.3497 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 -0.7901 2.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4170 0.1578 1.3676 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9592 0.1969 0.4041 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5133 1.7270 3.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5451 3.5729 2.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7466 3.7063 -0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1141 3.5407 0.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0031 1.5647 -1.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3093 0.5627 -2.1837 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 1.7164 -2.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1066 0.4702 -1.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2809 2.3264 0.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2909 3.5269 -0.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1004 1.5820 0.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1664 3.3333 0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3414 2.0789 -2.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6392 3.7648 -2.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3398 4.3019 -1.7217 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6426 3.5243 -3.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3967 1.5007 -2.5795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5581 3.0279 -2.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 0.6677 1.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8656 2.3263 1.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6432 0.8162 1.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0991 -0.4990 -0.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4713 -0.8565 0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -4.3167 -0.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8281 -4.6121 -1.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0459 -4.6745 -1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6156 -3.1165 -3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0261 -4.8166 -4.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5245 -2.2642 -3.8491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -3.7422 -3.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3809 4.5764 0.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8458 3.5781 0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2366 3.4170 -1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5926 4.4487 -2.1329 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9214 2.7231 -2.9338 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2722 2.5929 -3.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1824 0.4189 -3.2778 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 0.6022 -2.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6691 0.6876 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7395 -0.7100 -1.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3997 0.4747 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2613 1.9360 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2642 -0.8123 -0.7507 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0555 0.6799 0.2598 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8293 0.4536 -2.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3398 1.9120 -1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2264 3.2192 0.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2561 1.8495 1.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3475 2.1753 1.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7479 0.6292 2.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3176 -0.8002 3.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9243 0.3237 3.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4922 -1.9109 3.0137 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2913 -0.8048 1.6574 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3904 -2.8187 1.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5607 -1.5105 0.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6202 -2.2207 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5737 -3.5160 1.7774 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4612 -4.4054 2.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6761 -3.1839 4.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0060 -4.4410 3.8416 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 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 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 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 2 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 49 47 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 7 67 1 0 8 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 72 1 0 11 73 1 0 12 74 1 0 13 75 1 0 14 76 1 0 14 77 1 0 15 78 1 0 15 79 1 0 16 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 1 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 40107 1 0 41108 1 0 41109 1 0 42110 1 0 42111 1 0 43112 1 0 43113 1 0 44114 1 0 45115 1 0 46116 1 0 46117 1 0 47118 1 0 49119 1 0 50120 1 0 50121 1 0 51122 1 0 51123 1 0 52124 1 0 52125 1 0 53126 1 0 53127 1 0 54128 1 0 54129 1 0 54130 1 0 M END