HMDB0013629 RDKit 3D PGD2 ethanolamide 65 65 0 0 0 0 0 0 0 0999 V2000 -7.4870 2.4439 0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9804 1.0875 0.4998 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8394 0.3903 1.2197 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6515 0.2132 0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9721 -0.6281 -0.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7742 -0.7944 -1.8186 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1360 -1.5854 -2.9205 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6817 -1.4841 -1.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -0.8845 -0.6909 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4989 -1.5153 0.0379 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5707 -2.9239 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4922 -3.6889 0.4071 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -3.3559 0.6663 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7268 -2.2106 0.1847 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9596 -1.4365 1.3486 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -1.4491 -0.7562 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2194 -0.0177 -0.9682 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 0.0777 -1.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 0.6320 -1.3582 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 1.2283 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8969 0.7051 0.7928 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2244 1.0407 0.2347 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2928 0.4470 1.1862 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 -0.4666 1.9657 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5443 0.8757 1.1621 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8834 1.3343 1.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9606 2.4201 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 1.7947 -1.1468 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6826 2.7932 0.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1000 2.3579 -1.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2934 3.1976 0.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3471 0.4709 -0.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7877 1.2540 1.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1892 -0.6207 1.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5396 0.9795 2.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3274 1.2640 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8081 -0.2241 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -1.6418 -0.5072 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8287 -0.1748 -1.4363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5037 0.2065 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9252 -2.5470 -2.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8785 -2.5301 -0.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5174 0.1837 -0.9763 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2818 -0.9783 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0975 -4.2974 0.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0956 -3.5010 1.7641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6617 -2.5523 -0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8894 -1.6032 1.6366 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2938 -1.9809 -1.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1455 0.5984 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5784 0.3937 -1.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4077 -0.3810 -2.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4241 0.5937 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8491 1.0904 0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8499 2.3405 -0.1574 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7955 1.1574 1.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7836 -0.3927 0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4486 2.1484 0.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4873 0.6791 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9033 0.0036 2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2852 1.7348 2.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6232 0.5600 0.7819 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3014 3.2692 0.2773 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 2.7961 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2980 1.1032 -1.3422 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 2 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 16 10 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 6 7 41 1 0 8 42 1 0 9 43 1 0 10 44 1 1 13 45 1 0 13 46 1 0 14 47 1 6 15 48 1 0 16 49 1 6 17 50 1 0 17 51 1 0 18 52 1 0 19 53 1 0 20 54 1 0 20 55 1 0 21 56 1 0 21 57 1 0 22 58 1 0 22 59 1 0 25 60 1 0 26 61 1 0 26 62 1 0 27 63 1 0 27 64 1 0 28 65 1 0 M END