HMDB0035333 RDKit 3D Ganoderic acid Me 90 93 0 0 0 0 0 0 0 0999 V2000 8.3018 2.6071 0.9669 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 2.2255 0.5017 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5253 2.6939 -0.5995 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1241 1.3783 1.2321 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8278 1.0034 0.8059 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8418 1.4729 1.8284 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4309 1.0251 1.5285 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3453 -0.4408 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3154 -1.1770 2.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0397 -0.6880 0.5525 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0613 -1.3760 1.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1794 -1.5045 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5555 -0.1564 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4345 0.7822 0.9775 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7661 0.0193 -1.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9999 -0.7650 -0.7342 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8702 -2.2601 -0.8878 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7789 -0.4160 0.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2928 1.0063 0.5186 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0585 1.2932 1.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3165 1.6727 1.6836 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9541 1.8079 0.3703 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0793 1.9565 2.8837 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5745 1.8513 4.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4011 2.3558 2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4413 -0.1728 -2.4573 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9421 -0.1788 -2.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4639 -1.4890 -2.7705 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2455 -1.7862 -3.9241 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7525 -3.1356 -4.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4413 -0.8525 -4.7428 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4892 0.3555 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4649 1.8611 -1.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8484 -0.1372 -0.7858 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8891 -0.1102 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1908 -0.6218 -1.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4028 -0.9056 0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8092 -0.4806 0.6397 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3813 -1.2078 1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6931 -0.8378 -0.5645 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2853 2.7666 2.0764 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0673 1.8536 0.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6257 3.5728 0.5229 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6511 1.5094 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1426 1.2213 2.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8277 2.5965 1.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0276 1.6277 0.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8094 1.2310 2.4193 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2055 -0.9539 3.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1095 -2.2511 2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4729 -0.7022 3.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1536 -1.8073 2.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -1.9244 0.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8348 -2.2004 -0.5663 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4183 1.2185 1.0618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1223 1.6460 0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5839 0.2112 1.9261 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0613 1.1152 -0.9154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6838 -0.4625 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -2.5946 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9442 -2.8000 0.0752 H 0 0 0 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3.4364 -1.5359 -1.8018 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9463 0.1283 -1.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4191 -2.0385 0.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8947 -2.1744 2.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4568 -1.4993 1.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4943 -0.5443 2.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9152 0.0381 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3115 -1.7185 -1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7070 -1.1795 -0.1885 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 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 23 25 1 0 15 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 27 32 1 0 32 33 1 0 32 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 38 5 1 0 37 8 1 0 34 10 1 0 32 13 1 0 1 41 1 0 1 42 1 0 1 43 1 0 5 44 1 0 6 45 1 0 6 46 1 0 7 47 1 0 7 48 1 0 9 49 1 0 9 50 1 0 9 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 14 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 16 59 1 0 17 60 1 0 17 61 1 0 17 62 1 0 18 63 1 0 18 64 1 0 19 65 1 0 19 66 1 0 20 67 1 0 22 68 1 0 22 69 1 0 22 70 1 0 25 71 1 0 26 72 1 0 26 73 1 0 27 74 1 0 30 75 1 0 30 76 1 0 30 77 1 0 33 78 1 0 33 79 1 0 33 80 1 0 35 81 1 0 36 82 1 0 36 83 1 0 37 84 1 0 39 85 1 0 39 86 1 0 39 87 1 0 40 88 1 0 40 89 1 0 40 90 1 0 M END