HMDB0033883 RDKit 3D 3-O-Methylglycyrol 48 51 0 0 0 0 0 0 0 0999 V2000 -3.4114 -0.0367 -3.3192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0266 -0.3400 -1.9935 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.3191 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7059 0.0189 -2.4423 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5987 0.0457 -2.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 0.3647 -2.8532 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8444 0.3944 -2.4612 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7829 0.6986 -3.2571 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2137 0.0982 -1.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3606 0.0251 -0.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6861 0.2565 -0.7842 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6951 0.1185 0.1557 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3745 -0.2497 1.4507 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4372 -0.3682 2.3357 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0584 -0.4742 1.7886 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0278 -0.3428 0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7237 -0.4865 0.8944 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1848 -0.2389 -0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8761 -0.2647 -0.7083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.5969 0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1627 -0.9028 1.4627 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2085 0.1105 2.4457 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4611 -0.6302 -0.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5126 -0.9966 0.7213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3223 0.1541 1.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6297 0.2517 1.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4218 -0.8223 0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3216 1.4527 1.6045 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4826 -0.3250 -3.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3404 1.0869 -3.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7565 -0.5303 -4.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9261 0.2650 -3.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8871 0.5406 -1.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7241 0.3002 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9525 -1.2115 2.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8355 -0.7597 2.8033 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7554 1.0151 2.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7918 -0.2226 3.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 0.3986 2.8434 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1143 -1.6022 1.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -1.6998 0.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7836 0.9645 1.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5187 -0.7110 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3715 -0.7802 -0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -1.8421 0.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7283 2.3795 1.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5730 1.2228 2.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2814 1.6461 1.0839 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 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 2 0 23 24 1 0 24 25 1 0 25 26 2 3 26 27 1 0 26 28 1 0 23 3 1 0 19 5 2 0 18 9 2 0 16 10 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 11 33 1 0 12 34 1 0 14 35 1 0 15 36 1 0 22 37 1 0 22 38 1 0 22 39 1 0 24 40 1 0 24 41 1 0 25 42 1 0 27 43 1 0 27 44 1 0 27 45 1 0 28 46 1 0 28 47 1 0 28 48 1 0 M END