HMDB0244632 RDKit 3D 7-Oxodehydroepiandrosterone 3-acetate 53 56 0 0 0 0 0 0 0 0999 V2000 6.5680 1.1868 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -0.0111 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -1.1297 -0.1148 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3258 0.0359 -0.0205 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4832 -1.1276 -0.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7298 -1.1989 1.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -1.4707 1.0762 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5771 -0.5422 0.0994 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 0.8781 0.5563 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2905 -0.6857 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 -0.3745 -2.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7576 0.0901 -2.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 0.7409 -3.2309 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6123 -0.2001 -1.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3241 0.9131 -0.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0155 1.9032 -1.3219 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3659 1.3117 -1.6879 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5397 0.1528 -0.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -0.7210 -0.9376 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5224 0.2891 0.2822 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 1.2129 1.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0978 -1.0346 0.8429 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.9292 1.2107 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8375 -0.9724 -0.0728 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6799 -1.1471 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4312 1.0458 0.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 2.0462 0.3244 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8946 1.4113 -1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1932 -1.9852 -0.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1335 -2.0483 1.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -0.3025 1.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8022 -1.3735 2.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1563 -2.5049 0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 1.1199 1.5093 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5391 1.6010 -0.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8646 1.0070 0.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1433 -0.4762 -3.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4079 -0.9224 -1.4808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7691 1.4482 0.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2673 2.7946 -0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4715 2.3201 -2.1607 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 1.0309 -2.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2011 2.0241 -1.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0485 1.3156 1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 2.1789 1.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6278 0.7636 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1968 -1.8803 0.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7318 -1.2190 1.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4154 -1.8273 1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4129 -0.0445 1.8128 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8076 -2.0514 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -0.4835 -2.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6545 -2.1582 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 10 25 1 0 25 5 1 0 24 8 1 0 24 14 1 0 20 15 1 0 1 26 1 0 1 27 1 0 1 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 9 34 1 0 9 35 1 0 9 36 1 0 11 37 1 0 14 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 21 44 1 0 21 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 23 49 1 0 23 50 1 0 24 51 1 0 25 52 1 0 25 53 1 0 M END