HMDB0257252 RDKit 3D Androst-5-en-3-one, 17-hydroxy-7-methyl-, (7alpha,17beta)- 52 55 0 0 0 0 0 0 0 0999 V2000 0.2233 2.7381 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1621 1.5970 1.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4923 1.2335 1.6483 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1902 0.2988 1.0749 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5336 -0.0342 1.6466 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 0.0310 0.4936 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6365 -0.3015 0.6807 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9898 0.4863 -0.8057 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6853 -0.0549 -1.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7746 -0.4883 -0.1195 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1695 -1.9328 0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3429 -0.3392 -0.4774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3293 -1.6848 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7783 -1.5341 -1.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5437 -0.7772 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -1.4909 1.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -0.3668 -0.5971 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6546 0.0985 0.4698 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5594 0.8279 -1.4674 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1539 1.2850 -1.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8847 0.5723 0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 0.3575 0.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5642 3.4761 0.3853 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2144 2.3797 -0.8888 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1947 3.2782 0.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4683 1.9101 2.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9092 1.7368 2.5194 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8503 0.6948 2.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5518 -1.0272 2.1182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 1.6112 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7639 0.2013 -1.5737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1243 0.7304 -1.8362 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -0.9123 -1.9683 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2668 -2.0722 0.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7067 -2.6480 -0.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -2.2115 1.2107 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.2216 -1.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2235 -2.3845 0.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1556 -2.0668 -1.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2198 -2.5519 -1.1151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9914 -1.0520 -2.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -2.2510 1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6288 -1.9963 1.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4543 -0.7777 2.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3672 -1.1877 -1.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2098 0.0279 1.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5992 0.4764 -2.5163 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3104 1.6400 -1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5093 1.0719 -1.9238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2114 2.4020 -0.9881 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3884 1.1255 1.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4973 -0.3659 1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 2 1 0 10 4 1 0 22 12 1 0 21 15 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 3 27 1 0 5 28 1 0 5 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 9 33 1 0 11 34 1 0 11 35 1 0 11 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 14 40 1 0 14 41 1 0 16 42 1 0 16 43 1 0 16 44 1 0 17 45 1 0 18 46 1 0 19 47 1 0 19 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 22 52 1 0 M END