HMDB0012165 RDKit 3D 4alpha-Carboxy-4beta-methyl-5alpha-cholesta-8-en-3beta-ol 80 83 0 0 0 0 0 0 0 0999 V2000 6.1175 2.3504 0.8555 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9076 1.1032 1.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3664 1.3913 0.8949 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4277 -0.0554 0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9476 -0.3257 0.5548 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5586 -1.4688 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1037 -1.8675 -0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8745 -3.0089 -1.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1885 -0.7429 -0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.0594 -1.5647 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8498 0.7676 -1.6322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2841 0.4906 -0.2935 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1545 0.6481 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8734 -0.3193 0.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2632 -1.4456 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2453 -1.3427 1.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7371 -0.9753 -0.0975 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0883 -1.7465 -1.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3466 -0.3954 0.1951 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5750 -1.4879 -0.8673 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9145 -0.9040 1.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4093 -0.9519 1.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8747 0.4726 1.2049 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2665 0.4668 1.2465 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3882 1.0640 -0.0850 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2448 0.4870 -1.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6835 2.5176 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 3.0527 0.9866 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4753 3.3260 -1.1765 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9308 0.8750 -0.3273 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1167 2.0071 0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7741 1.9361 -0.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3552 2.5145 1.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7762 3.2667 0.8564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6528 2.3031 -0.1509 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7228 0.7958 2.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 2.4764 1.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6203 1.0907 -0.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0009 0.7712 1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0509 -0.9535 0.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5875 0.2731 -0.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4279 0.6155 0.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7792 -0.5781 1.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8369 -1.2747 -1.3919 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1715 -2.3479 -0.0186 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0281 -2.3128 0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9935 -2.7525 -2.2035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9542 -3.5963 -0.9158 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -3.7455 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4918 0.0046 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9821 0.8602 -1.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2896 -0.5641 -2.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9821 1.8701 -1.7536 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2134 0.3647 -2.4197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8735 1.0425 0.4963 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5864 -2.4267 0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7013 -1.3558 2.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.2714 1.6653 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4626 -0.4831 1.9461 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2929 -2.7076 -0.8173 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7734 -1.8681 -2.0765 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7914 -1.2134 -1.6291 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6565 -1.5897 -1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1564 -1.1366 -1.8473 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -2.4542 -0.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5587 -0.2788 2.3231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5352 -1.9637 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8425 -1.2774 2.3787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7751 -1.5597 0.5708 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5223 1.0553 2.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6428 -0.4549 1.1127 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 1.1639 -1.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7487 -0.4680 -0.8895 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6562 0.2974 -2.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2577 4.2988 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7493 0.9198 -1.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9438 1.8589 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 2.9635 0.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1755 2.8184 -0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 2.0317 -1.5585 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 6 14 19 1 0 19 20 1 6 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 1 27 28 2 0 27 29 1 0 25 30 1 0 30 31 1 0 31 32 1 0 17 9 1 0 30 19 1 0 17 12 1 0 32 13 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 3 37 1 0 3 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 5 42 1 0 5 43 1 0 6 44 1 0 6 45 1 0 7 46 1 0 8 47 1 0 8 48 1 0 8 49 1 0 9 50 1 0 10 51 1 0 10 52 1 0 11 53 1 0 11 54 1 0 12 55 1 0 15 56 1 0 15 57 1 0 16 58 1 0 16 59 1 0 18 60 1 0 18 61 1 0 18 62 1 0 20 63 1 0 20 64 1 0 20 65 1 0 21 66 1 0 21 67 1 0 22 68 1 0 22 69 1 0 23 70 1 1 24 71 1 0 26 72 1 0 26 73 1 0 26 74 1 0 29 75 1 0 30 76 1 0 31 77 1 0 31 78 1 0 32 79 1 0 32 80 1 0 M END