HMDB0244523 RDKit 3D (9Z,11E,13S,15Z)-13-Hydroxyoctadeca-9,11,15-trienoic acid 51 50 0 0 0 0 0 0 0 0999 V2000 -8.6479 -0.6497 0.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1958 -1.0350 0.5073 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8403 -0.5166 -0.8054 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9094 0.3260 -1.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 0.9411 -0.1047 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5445 0.6093 -0.4034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3628 -0.7715 -0.3621 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7274 1.2819 0.6391 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4082 1.2642 0.5383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7865 0.5908 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5057 0.5125 -0.7815 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4614 1.1162 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4062 0.0741 0.7482 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2067 -0.6437 -0.2957 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0794 0.2311 -1.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1011 0.9953 -0.3394 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0456 0.1290 0.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8154 -0.7779 -0.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7305 -1.6072 0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7896 -1.5062 1.5409 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5433 -2.5203 -0.3452 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7427 -0.4791 1.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8458 0.2936 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3142 -1.4817 0.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0993 -2.1641 0.5271 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5636 -0.6416 1.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4506 -0.9009 -1.6538 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 0.6471 -2.1468 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2017 0.5935 0.9108 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1525 2.0608 -0.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2793 0.9403 -1.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0279 -1.2102 -0.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1936 1.7877 1.4826 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8742 1.7705 1.3277 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4426 0.1038 -1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8701 -0.0180 -1.6607 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0395 1.6523 1.0053 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1527 1.8256 -0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7692 -0.6378 1.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0531 0.6508 1.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 -1.1054 -1.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7432 -1.5305 0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4477 0.9487 -1.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5745 -0.4067 -1.8888 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7179 1.5674 -1.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 1.7665 0.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5648 -0.5131 1.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7623 0.7978 0.9513 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0563 -1.4687 -0.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3562 -0.2041 -1.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4614 -2.6880 0.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 3 9 10 1 0 10 11 2 3 11 12 1 0 12 13 1 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 2 0 19 21 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 9 34 1 0 10 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 15 43 1 0 15 44 1 0 16 45 1 0 16 46 1 0 17 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 21 51 1 0 M END