HMDB0034880 RDKit 3D 3-Methyl-2,4-nonanedione 30 29 0 0 0 0 0 0 0 0999 V2000 4.4483 -0.9061 -0.6626 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6456 0.2002 -0.0489 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1477 0.0440 -0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4537 1.1858 0.3012 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0195 1.2363 0.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7617 0.0878 0.6605 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2076 -0.8652 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2301 0.0296 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8016 -1.2483 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7139 0.0579 -0.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1828 0.0058 -1.0889 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0039 0.1203 -1.8336 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7103 -1.6965 -0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1635 -1.2866 0.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9877 -0.5352 -1.5809 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7691 0.1954 1.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 1.1814 -0.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8607 -0.9073 0.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0205 0.0062 -1.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7738 1.2137 1.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8688 2.1290 -0.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3754 2.1404 0.7142 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2369 1.3607 -0.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 0.8796 1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9404 -2.0399 0.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8232 -1.0051 1.5196 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2151 -1.5899 2.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7389 -0.1031 -0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5472 0.9333 -1.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4115 -0.8240 -1.7915 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 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 2 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 8 24 1 0 9 25 1 0 9 26 1 0 9 27 1 0 11 28 1 0 11 29 1 0 11 30 1 0 M END