HMDB0060932 RDKit 3D N-Desmethyl sildenafil (UK-103,320) 60 63 0 0 0 0 0 0 0 0999 V2000 -1.9826 -3.3500 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3472 -3.6548 0.3067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0644 -2.5184 0.9495 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2909 -1.3526 0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4329 -1.0866 -0.6354 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 0.0118 -1.3465 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 0.6083 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0659 0.4810 -1.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4036 1.5958 -1.5823 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0155 2.3466 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1583 1.8271 -1.1659 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4813 1.0352 -0.3013 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.3740 0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6414 0.6275 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9435 1.0097 1.3289 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8261 0.0151 2.4291 S 0 0 0 0 0 6 0 0 0 0 0 0 1.8225 -0.7080 3.3188 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6237 0.9061 3.3353 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8115 -1.1610 1.7198 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -2.1419 0.9303 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1207 -3.1665 0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1212 -2.4536 -0.3975 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9087 -1.6930 0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1146 -0.7505 1.3732 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4964 2.1549 0.8045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 2.8999 -0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4644 2.5277 -0.4144 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2968 3.2757 -1.2894 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0918 4.4680 -1.9186 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4093 5.5538 -0.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1219 -0.0433 0.1511 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3986 -0.3429 -0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9702 -2.5640 -0.9761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3559 -3.0165 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4853 -4.2935 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -4.0506 -0.4925 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3246 -4.4876 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5401 -2.1998 1.8809 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0774 -2.9090 1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5522 1.6241 -1.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8512 0.7005 -3.2265 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1859 -0.0499 -2.2497 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2131 -0.2772 1.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5616 -1.6927 0.1041 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4269 -2.6815 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6726 -3.5968 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5955 -3.9350 -0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -3.0976 -0.8848 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -2.4188 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6955 -1.1154 0.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6885 -0.5794 2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1053 0.2465 0.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5054 2.4074 1.1095 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1913 3.7961 -0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9613 4.2515 -2.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7593 4.8090 -2.5495 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2823 6.4321 -1.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4274 5.9766 -1.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2869 5.1130 0.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6559 -0.6866 0.8257 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 2 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 2 0 16 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 15 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 1 0 29 30 1 0 12 31 1 0 31 32 1 0 32 4 1 0 32 8 2 0 27 13 1 0 24 19 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 3 38 1 0 3 39 1 0 7 40 1 0 7 41 1 0 7 42 1 0 14 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 22 48 1 0 23 49 1 0 23 50 1 0 24 51 1 0 24 52 1 0 25 53 1 0 26 54 1 0 29 55 1 0 29 56 1 0 30 57 1 0 30 58 1 0 30 59 1 0 31 60 1 0 M END