HMDB0039727 RDKit 3D Trehalulose 45 46 0 0 0 0 0 0 0 0999 V2000 -5.2357 -2.3777 -0.5562 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2361 -1.7571 -1.2936 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2817 -0.9800 -0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3347 -0.4038 -1.2044 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3753 0.3243 -0.5261 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2514 -0.4135 -0.2113 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 0.1711 -0.8309 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1321 -0.5728 -0.5416 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -1.8994 -0.9927 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1457 0.0419 -1.2205 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1139 0.4456 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4851 0.2856 -0.9476 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4831 0.6895 -0.0722 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9608 -0.4283 0.9051 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4363 0.1975 2.0338 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4569 -0.6102 0.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 0.5247 1.5463 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8969 0.9298 0.7546 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1964 2.1227 1.0027 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3398 1.2976 0.5769 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4454 2.1878 -0.4611 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1208 0.0251 0.3581 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3155 0.3178 -0.2888 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0462 -2.3884 0.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6763 -2.4546 -1.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6891 -0.9855 -1.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8591 -1.7260 0.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0794 1.1662 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9471 1.1998 -0.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6682 0.0933 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9576 -2.2331 -1.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 1.5125 -0.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5337 0.9471 -1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6085 -0.7514 -1.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1673 1.4319 0.5015 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -1.3849 0.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5662 -0.4975 2.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1489 -1.5399 1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 0.2627 2.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7106 0.2637 1.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7604 2.7838 1.4878 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7266 1.7965 1.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2298 2.0514 -1.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -0.3695 1.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9256 0.7037 0.4012 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 11 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 5 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 3 1 0 16 8 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 5 28 1 0 7 29 1 0 7 30 1 0 9 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 16 38 1 0 17 39 1 0 18 40 1 0 19 41 1 0 20 42 1 0 21 43 1 0 22 44 1 0 23 45 1 0 M END