HMDB0285568 RDKit 3D PE(P-18:1(9Z)/18:3(9,11,15)-OH(13)) 125124 0 0 0 0 0 0 0 0999 V2000 16.5633 -0.6866 1.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9453 -1.1902 0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5206 -0.6995 0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0861 0.1196 -0.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6879 0.6207 -0.8253 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7988 0.1214 0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2752 0.4964 1.5526 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4798 0.7456 0.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4718 1.2769 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2517 1.9327 -0.2687 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3853 1.4317 -1.1942 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0595 1.9319 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1034 0.7912 -1.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8117 0.0672 -0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9765 -0.4807 0.5593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7427 -1.5336 1.5307 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9058 -1.6564 2.6869 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -1.5735 2.6888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7419 -0.3114 2.6014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1105 0.7191 3.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4904 -0.2877 1.8846 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7086 0.9056 1.8681 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6705 0.4182 2.4031 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0685 -0.7020 1.8075 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4072 -1.4350 0.7589 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3922 -1.0957 -0.0629 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8584 -1.8251 -1.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2726 -2.3483 -0.9569 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1423 -1.1372 -0.5508 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3382 -0.2376 -1.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9888 1.0491 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3207 1.2858 -0.9909 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4551 0.5319 -1.3761 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3268 -0.1051 -0.5984 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1179 -0.0556 0.8776 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3321 0.5875 1.4847 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5277 -0.3178 1.2862 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8078 0.3084 1.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9682 -0.6511 1.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1888 -1.0679 0.2317 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4843 0.0947 -0.6577 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7341 0.8461 -0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 1.6657 0.6124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 1.1268 -0.3256 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0701 1.9892 -1.8810 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.4303 2.5015 -2.2615 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9265 3.3194 -1.5291 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 0.8893 -2.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0967 0.0854 -3.5042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0578 -1.3501 -2.7149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7544 -1.1312 -1.5134 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4466 -0.0331 1.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8724 -1.5084 2.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8538 -0.0278 2.0296 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0191 -2.2800 0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4545 -0.6950 -0.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8121 -1.0499 0.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8072 0.4270 -1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2378 0.3092 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6818 1.7464 -0.7465 H 0 0 0 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85 1 0 27 86 1 0 27 87 1 0 28 88 1 0 28 89 1 0 29 90 1 0 29 91 1 0 30 92 1 0 30 93 1 0 31 94 1 0 31 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 34 99 1 0 35100 1 0 35101 1 0 36102 1 0 36103 1 0 37104 1 0 37105 1 0 38106 1 0 38107 1 0 39108 1 0 39109 1 0 40110 1 0 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