HMDB0004241 RDKit 3D 6-Ketoprostaglandin E1 58 58 0 0 0 0 0 0 0 0999 V2000 -7.0751 -0.7235 1.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0880 0.3379 0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7742 0.9081 -0.3369 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7431 0.0288 -0.9352 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2887 -1.1302 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1692 -1.8857 -0.8935 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7641 -2.9616 -0.1429 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0362 -0.9388 -1.1877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3161 -0.3951 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2144 0.5290 -0.5539 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4760 1.8307 0.1845 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7621 2.7842 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8034 2.1513 0.9471 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8032 1.3570 0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8982 1.7005 -0.1438 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1455 0.0612 -0.0630 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7402 -0.7590 -1.1525 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0719 -1.3037 -0.9044 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5734 -1.9759 -1.8027 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -1.1320 0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2772 -0.6047 -0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0943 -0.4184 1.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4744 0.1137 0.8679 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4579 1.4344 0.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4626 1.9489 -0.3388 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2751 2.1561 0.1622 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9615 -0.5479 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1439 -0.7117 1.6091 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2913 -1.7192 0.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7178 1.1858 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 -0.0345 -0.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3912 1.4326 0.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9934 1.8002 -1.0167 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8399 0.6918 -1.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0688 -0.2980 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0896 -1.8984 -0.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8769 -0.8019 0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6003 -2.1973 -1.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2931 -3.7689 -0.3349 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7683 -0.6642 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5359 -0.6244 0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1634 0.6750 -1.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3383 1.7602 0.8831 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8003 2.3961 -1.6879 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0178 3.2162 1.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6994 1.6273 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0087 -0.5018 0.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7339 -0.1510 -2.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0514 -1.6446 -1.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4224 -0.6224 1.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0853 -2.1865 0.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2229 0.3033 -0.6466 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7663 -1.4082 -0.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2755 -1.4063 1.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6429 0.2419 1.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0819 0.2359 1.7904 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -0.6221 0.2254 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2135 3.1301 -0.1327 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 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 16 10 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 6 38 1 6 7 39 1 0 8 40 1 0 9 41 1 0 10 42 1 6 11 43 1 1 12 44 1 0 13 45 1 0 13 46 1 0 16 47 1 1 17 48 1 0 17 49 1 0 20 50 1 0 20 51 1 0 21 52 1 0 21 53 1 0 22 54 1 0 22 55 1 0 23 56 1 0 23 57 1 0 26 58 1 0 M END