HMDB0034239 RDKit 3D 2-Methylpropyl propanoate 23 22 0 0 0 0 0 0 0 0999 V2000 -3.3255 -0.5748 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9115 0.7645 0.5295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 1.0752 -0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4352 2.0230 -0.8866 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4512 0.3243 0.2895 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7766 0.6812 -0.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9124 -0.2051 0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1565 0.2760 -0.5968 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6487 -1.6635 -0.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6892 -1.3875 0.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4005 -0.7116 0.2158 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1889 -0.5181 -1.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8863 0.8182 1.6112 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6101 1.5403 0.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0748 1.7247 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6171 0.7337 -1.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0593 -0.1302 1.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9584 1.1942 -1.2184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5304 -0.4876 -1.3241 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 0.5529 0.1255 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5295 -2.2263 0.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7611 -1.9715 0.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4737 -1.8324 -1.2827 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 6 7 1 0 7 8 1 0 7 9 1 0 1 10 1 0 1 11 1 0 1 12 1 0 2 13 1 0 2 14 1 0 6 15 1 0 6 16 1 0 7 17 1 0 8 18 1 0 8 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 9 23 1 0 M END