HMDB0029166 RDKit 3D 2-Methyl-3-hydroxyvaleric acid 21 20 0 0 0 0 0 0 0 0999 V2000 2.4922 0.0347 -0.8104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0858 -0.4846 -0.5538 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3301 0.5767 0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.8410 1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1011 0.2217 0.4498 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2945 -0.9785 1.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7816 0.0391 -0.8668 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3236 -1.0223 -1.2267 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7829 1.1482 -1.7038 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0841 -0.6482 -1.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0284 0.2180 0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4555 1.0105 -1.3504 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.7710 -1.5161 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1864 -1.3569 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3962 1.5203 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5186 0.5237 2.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5918 1.0880 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4844 -1.2422 1.9616 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2181 -0.8607 1.9218 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5205 -1.8671 0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 2.0097 -1.2910 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 3 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 7 9 1 0 1 10 1 0 1 11 1 0 1 12 1 0 2 13 1 0 2 14 1 0 3 15 1 0 4 16 1 0 5 17 1 0 6 18 1 0 6 19 1 0 6 20 1 0 9 21 1 0 M END