HMDB0260763 RDKit 3D PE(18:3(10,12,15)-OH(9)/14:1(9Z)) 114113 0 0 0 0 0 0 0 0999 V2000 15.9793 0.2390 4.1191 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8653 0.8558 3.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7684 -0.1361 3.1785 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3811 -0.5602 1.9853 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2851 -1.5497 1.8768 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1900 -0.9271 1.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7714 -1.4656 -0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7202 -0.9296 -0.9047 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3819 -1.5468 -1.9998 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3553 -1.1498 -2.9562 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0293 -0.4242 -3.9768 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2795 -0.2551 -2.4501 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4593 -0.7935 -1.3251 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3904 0.2233 -0.9114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4575 0.4980 -2.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4381 1.5304 -1.5965 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 1.8016 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6873 0.5453 -3.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8873 0.0644 -1.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -1.0417 -2.0201 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7721 0.7860 -0.7679 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0634 0.4435 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4013 0.2950 0.0622 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9588 1.5048 -0.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 1.8043 -1.8059 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8312 3.1214 -2.6513 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.6495 4.0602 -2.8981 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 4.0190 -1.7693 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4384 2.7106 -4.1709 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 2.8996 -4.2814 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2456 2.5066 -5.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6108 3.2784 -6.7049 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1659 0.0076 1.2011 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9362 -1.1666 1.3481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8681 -1.9360 0.3568 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7241 -1.3987 2.5725 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1578 -1.7255 2.2698 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -2.9658 1.4933 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8493 -3.2381 1.1684 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6276 -3.3760 2.4274 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0999 -3.6590 2.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7219 -2.5289 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5239 -1.2570 2.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4865 -0.4715 2.5836 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9353 -0.7083 2.4189 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5649 0.4365 1.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3542 1.7677 2.3157 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0141 1.6886 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2435 0.9355 4.9467 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8515 0.0659 3.4411 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6105 -0.6836 4.5828 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2020 1.1587 2.3008 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4642 1.7649 3.8227 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2974 -0.5018 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8777 -0.1696 1.1153 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9083 -1.8671 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7040 -2.4383 1.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7287 -0.0227 1.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2822 -2.3855 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2291 -0.0303 -0.6246 H 0 0 0 0 0 0 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