HMDB0032272 RDKit 3D Ethyl 4-methylpentanoate 26 25 0 0 0 0 0 0 0 0999 V2000 4.1820 -0.3411 -0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3994 0.1740 0.9852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0506 0.4875 0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2255 -0.5282 0.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6946 -1.6895 0.0736 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1881 -0.2803 -0.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9878 0.0543 1.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4314 0.3130 0.7857 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1613 -0.8682 0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6601 1.5611 -0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7501 0.0767 -1.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2466 0.0124 -0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1828 -1.4347 -0.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9259 1.0312 1.3957 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3821 -0.6887 1.7213 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3032 0.5191 -0.9622 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6035 -1.2162 -0.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5817 0.9857 1.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8761 -0.7708 1.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8986 0.5448 1.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -0.5036 -0.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7942 -1.3717 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 -1.6480 -0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0631 1.5293 -0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7402 1.6358 -0.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3404 2.4163 0.5516 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 7 8 1 0 8 9 1 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 6 16 1 0 6 17 1 0 7 18 1 0 7 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 10 25 1 0 10 26 1 0 M END