HMDB0000754 RDKit 3D 3-Hydroxyisovaleric acid 18 17 0 0 0 0 0 0 0 0999 V2000 -1.0475 -1.4321 -0.9596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5313 -0.0583 -0.5105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3016 0.3065 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7312 0.8091 -1.5609 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9305 -0.2216 -0.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5814 1.0256 0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9968 2.1281 0.3592 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 0.9803 0.5037 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0666 -1.3298 -1.4167 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0537 -2.1413 -0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3662 -1.7656 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1744 -0.3798 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6369 0.2013 1.6003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7061 1.3212 0.6762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9259 1.7312 -1.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -1.0423 0.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4323 -0.5231 -1.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5783 0.3906 -0.0128 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 2 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 1 9 1 0 1 10 1 0 1 11 1 0 3 12 1 0 3 13 1 0 3 14 1 0 4 15 1 0 5 16 1 0 5 17 1 0 8 18 1 0 M END