HMDB0246835 RDKit 3D 5-Oxo-6,8,11,14-eicosatetraenoic acid 53 52 0 0 0 0 0 0 0 0999 V2000 7.5835 0.0033 -0.3688 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8223 -0.2647 1.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 -0.2895 1.8828 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7473 0.8715 2.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0501 1.5345 0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0974 0.6883 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2666 0.5069 -1.1123 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3117 -0.3379 -1.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2357 -0.8996 -1.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9694 -0.6572 -1.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0664 -1.2681 -0.3601 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8577 -0.1982 0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.1067 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9759 -1.0150 -0.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2675 -0.9456 -0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1779 0.0295 -0.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8201 0.9695 0.3784 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6344 -0.0832 -0.6548 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4480 0.9873 0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8973 0.8362 -0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4728 -0.4622 0.0779 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2394 -1.5462 -0.5076 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3425 -0.5364 1.1782 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3921 1.0232 -0.6773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7949 -0.6847 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4967 -0.3182 -0.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2677 -1.3140 1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6490 0.3551 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8615 -0.6703 2.9348 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 -1.1681 1.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9229 0.5563 2.7942 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3004 1.6436 2.7048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6295 2.1500 0.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3604 2.3116 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2673 0.2260 0.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1032 0.9758 -1.6327 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8455 0.3330 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -1.1673 -2.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -1.5347 -0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6145 -0.0479 -2.0712 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6033 -1.9939 -0.9658 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4558 -1.8616 0.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3388 0.5631 0.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6329 0.7432 0.5717 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4832 -1.8642 -1.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7201 -1.7436 -1.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7925 0.0802 -1.7633 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9502 -1.1045 -0.3953 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0906 1.9661 -0.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2855 0.8876 1.1214 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4661 1.6499 0.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0286 0.9343 -1.4141 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2000 0.1497 1.9063 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 3 7 8 1 0 8 9 1 0 9 10 2 3 10 11 1 0 11 12 1 0 12 13 2 3 13 14 1 0 14 15 2 3 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 12 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 18 47 1 0 18 48 1 0 19 49 1 0 19 50 1 0 20 51 1 0 20 52 1 0 23 53 1 0 M END