HMDB0033825 RDKit 3D Corbisterol 76 79 0 0 0 0 0 0 0 0999 V2000 4.9135 1.0340 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4457 1.1033 0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1592 0.2538 -0.7259 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9873 -0.0089 -1.4627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8049 -0.3575 -1.0997 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3265 -0.5941 0.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0288 -1.4389 1.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1992 0.2006 0.7745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2571 1.6410 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 2.1579 0.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9725 0.9033 1.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3401 0.8983 0.6047 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9453 2.0069 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3264 1.9899 -0.2589 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0035 0.8767 -0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3949 0.9208 -0.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2872 0.3170 0.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5311 0.0734 -0.3745 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7814 -1.0156 0.7493 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3598 -0.9790 1.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4214 -0.4042 0.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5111 -1.3082 -1.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0416 -0.4105 0.6137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1764 -1.3905 -0.1309 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7216 -1.3795 0.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1618 -0.0286 0.1347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2189 0.4982 -1.2782 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3205 -0.7636 -0.9959 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6191 -0.0424 -1.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9439 -1.4631 -2.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3761 1.8141 2.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1919 0.0754 2.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8456 1.2590 1.8005 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5908 1.2187 0.5786 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2638 2.2010 0.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6453 0.9843 -1.5595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0614 0.0821 -2.6491 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.4639 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6031 -1.5135 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6653 -2.4740 1.3515 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1086 -1.6019 0.9109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9811 -1.0345 2.2489 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0472 -0.2347 1.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8045 2.2217 0.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5976 1.9170 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4193 2.8575 1.6775 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3897 2.6676 -0.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 0.5180 2.0802 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3611 2.9120 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7495 2.9610 -0.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7309 1.9791 -0.9362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4297 0.3688 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4482 1.0528 1.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0392 -0.6341 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0331 -1.8213 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3819 -1.2303 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0276 -1.9906 1.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2412 -0.3172 2.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6093 -1.4220 -1.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1407 -2.3152 -0.9833 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0222 -0.8084 -1.9871 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0785 -0.8077 1.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5451 -2.4156 0.1794 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2266 -1.3450 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -2.2053 -0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6616 -1.6393 1.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1787 1.0531 -1.3882 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.3486 -1.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5654 1.2357 -1.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5341 -1.3762 -0.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2409 0.0599 -0.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4015 0.9307 -1.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2286 -0.6590 -1.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 -0.8253 -3.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5178 -2.4215 -2.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8808 -1.7548 -2.3113 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 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 3 28 1 0 28 29 1 0 28 30 1 0 26 8 1 0 26 11 1 0 23 12 1 0 21 15 1 0 1 31 1 0 1 32 1 0 1 33 1 0 2 34 1 0 2 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 9 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 11 48 1 0 13 49 1 0 14 50 1 0 16 51 1 0 16 52 1 0 17 53 1 0 18 54 1 0 19 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 22 59 1 0 22 60 1 0 22 61 1 0 23 62 1 0 24 63 1 0 24 64 1 0 25 65 1 0 25 66 1 0 27 67 1 0 27 68 1 0 27 69 1 0 28 70 1 0 29 71 1 0 29 72 1 0 29 73 1 0 30 74 1 0 30 75 1 0 30 76 1 0 M END