HMDB0059867 RDKit 3D Ethyl 2-hydroxy-4-methylpentanoate 27 26 0 0 0 0 0 0 0 0999 V2000 4.4320 0.5731 0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5205 -0.5903 -0.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1808 -0.1268 -0.3481 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1397 -1.0104 -0.5964 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4156 -2.2350 -0.6162 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2414 -0.5451 -0.8296 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0531 -1.6559 -1.0478 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8084 0.2604 0.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2158 0.6691 -0.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1413 -0.4824 -0.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8223 1.5999 0.9368 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4515 0.2883 -0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4115 0.7958 1.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0413 1.4384 -0.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8303 -1.0704 -1.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5512 -1.3375 0.6894 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2663 0.0653 -1.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8408 -2.0677 -1.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.2830 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2403 1.2148 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1953 1.2606 -1.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1887 -0.8088 -1.3972 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9179 -1.3390 0.3049 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1813 -0.0955 -0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2489 2.5214 0.4895 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6957 1.0864 1.4359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0848 1.8740 1.7127 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 4 5 2 0 4 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 6 17 1 0 7 18 1 0 8 19 1 0 8 20 1 0 9 21 1 0 10 22 1 0 10 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 11 27 1 0 M END