HMDB0059943 RDKit 3D 2-(2-Methylphenyl)-1,3-dioxan-5-ol 28 29 0 0 0 0 0 0 0 0999 V2000 -1.3477 -1.8379 0.5353 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9064 -0.5607 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2573 -0.2993 -0.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 0.9016 -0.5234 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 1.8644 -0.9297 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5174 1.5946 -0.8471 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0061 0.4039 -0.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 0.2450 -0.3386 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8964 -0.9706 -0.8122 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2688 -0.9748 -0.8862 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9412 -0.3867 0.3345 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2622 -0.0905 -0.0172 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2409 0.8374 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8732 0.5040 0.9649 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0282 -2.4865 -0.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1782 -2.3728 1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5569 -1.6952 1.2877 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9285 -1.0643 0.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8235 1.1019 -0.5834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2752 2.7948 -1.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8547 2.4066 -1.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9139 1.0227 -0.9719 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 -2.0560 -0.9691 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5765 -0.4493 -1.8202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9436 -1.1358 1.1488 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3609 -0.0666 -1.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 1.7030 0.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6639 1.0670 1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 7 2 1 0 14 8 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 8 22 1 0 10 23 1 0 10 24 1 0 11 25 1 0 12 26 1 0 13 27 1 0 13 28 1 0 M END