HMDB0285181 RDKit 3D PE(20:4(5Z,8Z,11Z,14Z)-OH(18R)/P-16:0) 125124 0 0 0 0 0 0 0 0999 V2000 12.9487 4.4870 -2.8935 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7431 2.9762 -3.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1140 2.5517 -1.7055 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8653 1.0709 -1.7534 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2023 0.6483 -0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0765 0.9261 0.7245 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 0.5101 2.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3172 1.2202 2.5016 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0367 1.2740 1.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3633 -0.0266 1.4869 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0554 0.1515 0.7651 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0697 0.9801 1.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7608 0.3641 2.8899 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -0.9672 2.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7664 -1.0823 2.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0269 -0.0517 2.0939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7707 -0.1423 1.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3466 -0.6325 0.3364 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1419 -0.4922 0.3452 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9091 -1.0173 -0.6495 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2275 -2.3542 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8258 -3.2143 0.0487 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0553 -2.7357 -1.9538 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1759 -1.8039 -2.1522 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1995 -1.6773 -1.0611 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -1.2145 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0859 -0.1071 0.8288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9969 0.9529 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6896 0.9355 -0.8202 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9901 0.8859 -0.9336 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9001 0.8415 0.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6775 -0.4208 0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9818 -0.4557 0.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8166 0.7607 0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6005 0.8696 -1.1797 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9006 0.9086 -1.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7821 0.8500 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6785 2.0345 0.0808 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0378 3.3638 0.2042 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.1803 3.4179 1.2978 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5052 3.9610 -1.0464 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8833 5.3305 -0.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9201 -1.9248 -0.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5211 -2.2759 -1.3609 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1763 -3.7385 -1.8376 P 0 0 0 0 0 5 0 0 0 0 0 0 2.2855 -3.6823 -3.3662 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7318 -4.0078 -1.2668 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1511 -5.0326 -1.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5855 -5.5721 -2.6127 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3163 -6.7133 -2.2107 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -7.7159 -1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7586 4.6400 -2.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0180 4.9633 -2.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1792 4.8977 -3.8945 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6976 2.4529 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0306 2.7289 -3.8382 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8755 2.7794 -0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2025 3.1014 -1.4714 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1195 0.8360 -2.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8120 0.5069 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0410 -0.4826 -0.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2293 1.1128 -0.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0280 0.3085 0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3834 2.0149 0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3155 -0.6120 1.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3650 0.6084 2.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5749 2.3299 2.7357 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1607 0.8634 3.5984 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3323 1.8237 2.5888 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0146 2.0300 1.0074 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1855 -0.6522 2.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0121 -0.6192 0.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2463 0.7034 -0.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6546 -0.8406 0.5102 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5251 1.9891 1.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1895 1.0934 0.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7368 0.2575 3.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1562 1.0272 3.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7804 -1.7587 2.4316 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0468 -1.2824 3.9793 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3991 -2.1232 2.1987 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4223 0.9588 2.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7352 0.1230 -0.4611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3166 0.6458 0.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5055 -0.7740 1.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3493 -3.8108 -1.9201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3664 -2.6178 -2.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7096 -0.7836 -2.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6542 -2.0439 -3.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5367 -2.8075 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0961 -1.2200 -1.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0125 -1.8626 0.7925 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5828 0.0484 1.8434 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6479 1.1829 1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3227 1.9063 0.4478 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0763 1.0000 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4392 0.8761 -1.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5037 1.7593 0.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4125 0.7990 1.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1091 -1.3508 0.0748 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4488 -1.4421 -0.0691 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5253 0.6079 0.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2803 1.6695 0.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0368 0.9217 -2.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3721 0.9894 -2.2243 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5011 -0.0374 -0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3107 0.6431 0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3547 2.0285 -0.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3807 1.9211 0.9522 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9184 4.0726 0.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2662 3.2531 0.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7253 3.3870 -1.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3700 4.1282 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5212 5.8810 -0.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8805 5.1877 -0.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8158 5.9097 -1.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0429 -1.8525 -0.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7432 -2.7561 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7137 -4.4109 -0.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3472 -5.8609 -3.3418 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.7698 -3.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7806 -7.1769 -3.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1139 -6.2794 -1.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1182 -8.5792 -1.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7122 -7.3752 -0.5531 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 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 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 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 18 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 45 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 1 52 1 0 1 53 1 0 1 54 1 0 2 55 1 0 2 56 1 0 3 57 1 0 3 58 1 0 4 59 1 0 4 60 1 0 5 61 1 0 5 62 1 0 6 63 1 0 6 64 1 0 7 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 9 70 1 0 10 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 12 76 1 0 13 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 16 82 1 0 18 83 1 6 19 84 1 0 19 85 1 0 23 86 1 0 23 87 1 0 24 88 1 0 24 89 1 0 25 90 1 0 25 91 1 0 26 92 1 0 27 93 1 0 28 94 1 0 28 95 1 0 29 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 36105 1 0 37106 1 0 37107 1 0 38108 1 0 38109 1 0 39110 1 1 40111 1 0 41112 1 0 41113 1 0 42114 1 0 42115 1 0 42116 1 0 43117 1 0 43118 1 0 47119 1 0 49120 1 0 49121 1 0 50122 1 0 50123 1 0 51124 1 0 51125 1 0 M END