HMDB0037023 RDKit 3D 2-Hydroxy-2,6,6-trimethylcyclohexanone 27 27 0 0 0 0 0 0 0 0999 V2000 1.7261 0.9815 1.1537 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1352 0.1454 0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1901 0.0928 -1.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9495 -1.2424 0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2988 -1.8649 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5101 -1.0426 0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 0.2359 -0.2929 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3363 1.3151 0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0119 -0.0344 -1.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0901 0.7319 -0.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 1.7146 -1.2525 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9773 1.3451 1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 0.3192 1.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3363 1.8148 0.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5795 -0.9345 -1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0288 0.7908 -0.8764 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7514 0.4386 -2.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8031 -1.9033 0.2728 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8605 -1.2221 1.6998 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4179 -2.9069 0.3386 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -1.7656 -1.0744 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4021 -1.6640 0.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5852 -0.9292 1.5613 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4231 1.2419 1.4055 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3516 1.3257 -0.1725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8762 2.2888 0.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8306 0.7277 -2.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 7 10 1 0 10 11 2 0 10 2 1 0 1 12 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 M END