HMDB0031507 RDKit 3D 1-Hydroxy-2-butanone 14 13 0 0 0 0 0 0 0 0999 V2000 -1.6373 0.1162 0.5507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8506 -0.8662 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5579 -0.4403 -0.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -1.2226 -1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1462 0.7899 0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4879 0.8646 -0.3022 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5238 -0.0252 1.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7319 0.0319 0.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2612 1.1396 0.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8203 -1.8191 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3221 -1.0806 -1.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6688 1.7237 -0.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1347 0.8341 1.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9088 -0.0460 -0.3016 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 1 7 1 0 1 8 1 0 1 9 1 0 2 10 1 0 2 11 1 0 5 12 1 0 5 13 1 0 6 14 1 0 M END