HMDB0000019 RDKit 3D alpha-Ketoisovaleric acid 16 15 0 0 0 0 0 0 0 0999 V2000 -1.2918 -0.9728 0.2156 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5333 0.3218 0.2781 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2104 1.4542 -0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7996 0.1215 -0.3234 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1082 0.8160 -1.3242 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7692 -0.8274 0.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4728 -1.5250 1.1693 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0127 -1.0097 -0.3941 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7572 -1.7096 -0.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3063 -0.8795 -0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3188 -1.4436 1.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4615 0.6365 1.3597 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4653 1.2087 -1.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0918 1.8519 0.1029 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4724 2.2899 -0.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7464 -0.3329 -0.4239 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 2 0 4 6 1 0 6 7 2 0 6 8 1 0 1 9 1 0 1 10 1 0 1 11 1 0 2 12 1 0 3 13 1 0 3 14 1 0 3 15 1 0 8 16 1 0 M END