HMDB0038036 RDKit 3D 2-Propenyl 3-methylbutanoate 24 23 0 0 0 0 0 0 0 0999 V2000 3.5991 0.7585 -0.4774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1994 -0.4791 -0.2475 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5595 -0.8156 1.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -1.3171 0.8668 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3101 -0.5016 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6859 0.6374 -0.1215 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -0.9112 0.0276 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8327 0.1933 -0.6503 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8155 1.4296 0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2662 -0.2913 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 1.5701 0.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0842 1.0493 -1.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3368 -1.2508 -0.9878 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5688 0.0822 1.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -1.6566 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.0486 1.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1878 -1.8836 -0.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3803 0.4068 -1.6309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8115 1.8538 0.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1593 2.2090 -0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3541 1.2533 1.2013 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1719 -1.1593 -1.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6924 -0.6436 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8973 0.5151 -1.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 1 11 1 0 1 12 1 0 2 13 1 0 3 14 1 0 3 15 1 0 7 16 1 0 7 17 1 0 8 18 1 0 9 19 1 0 9 20 1 0 9 21 1 0 10 22 1 0 10 23 1 0 10 24 1 0 M END