HMDB0060607 RDKit 3D Fluoxetine glucuronide 60 62 0 0 0 0 0 0 0 0999 V2000 -0.8362 0.4914 -1.4989 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 0.4096 -0.2359 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6665 0.3517 0.9695 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1521 -0.9573 0.9661 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5731 -0.7641 0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9006 -0.0294 -0.5674 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 0.7799 -0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 1.4557 -1.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6454 2.2439 -1.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 2.3672 -0.4296 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6104 3.1586 -0.3024 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4734 2.3278 0.4278 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3568 4.2869 0.4181 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1505 3.3952 -1.5562 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9378 1.7328 0.7221 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7651 0.9178 0.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -2.1698 0.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8762 -2.9339 1.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 -4.1743 0.5689 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0712 -4.6021 -0.7154 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3005 -3.8181 -1.5473 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8301 -2.5992 -1.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7659 0.4272 -0.1423 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2088 0.7500 1.1433 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 1.3675 0.9268 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8482 2.2479 1.9853 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0922 2.3541 3.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0009 2.9798 1.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4659 0.3109 0.5021 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6862 0.9618 0.3265 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9915 -0.2068 -0.8345 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8385 -1.1673 -1.3514 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -0.7261 -0.6315 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0688 -1.3740 -1.7416 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -0.4808 -1.9045 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1581 1.3582 -1.7399 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6722 0.6678 -2.2904 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2437 0.5022 1.8733 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1663 1.1444 0.9444 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -1.2992 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3468 -1.6832 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -0.5102 1.4546 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9444 1.3168 -2.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9821 2.7638 -2.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4574 1.8296 1.6605 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5188 0.4277 1.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1289 -2.6466 2.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9644 -4.8075 1.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4446 -5.5644 -1.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -4.1612 -2.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2425 -2.0053 -1.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1375 1.3032 -0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 1.9959 -0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2511 3.5059 1.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5655 -0.5039 1.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0122 0.9032 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8904 0.6820 -1.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1255 -0.8473 -2.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6588 -1.4754 0.2037 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6029 -2.2111 -1.4320 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 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 10 15 1 0 15 16 2 0 5 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 2 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 25 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 16 7 1 0 22 17 1 0 33 23 1 0 1 35 1 0 1 36 1 0 1 37 1 0 3 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 5 42 1 0 8 43 1 0 9 44 1 0 15 45 1 0 16 46 1 0 18 47 1 0 19 48 1 0 20 49 1 0 21 50 1 0 22 51 1 0 23 52 1 6 25 53 1 6 28 54 1 0 29 55 1 1 30 56 1 0 31 57 1 6 32 58 1 0 33 59 1 1 34 60 1 0 M END