HMDB0032365 RDKit 3D Maltyl isobutyrate 26 26 0 0 0 0 0 0 0 0999 V2000 -1.2137 0.7660 -2.1285 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 0.1551 -0.9606 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1757 -0.1979 -1.0823 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8495 -0.7354 -0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -0.9777 1.1331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.6334 1.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3746 -0.8237 2.4397 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3079 -0.0633 0.2453 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0336 0.3106 0.3762 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0384 -0.5937 0.0736 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7416 -1.7477 -0.3177 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4839 -0.2300 0.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8378 0.9368 -0.6879 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7287 0.1307 1.6569 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 1.8254 -2.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5132 0.3059 -3.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1323 0.7883 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9044 -1.0305 -0.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8355 -1.4261 1.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1274 -1.0912 -0.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6584 0.6247 -1.7411 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9063 1.1635 -0.5109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2552 1.8374 -0.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7955 0.0496 1.9343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3531 1.1784 1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -0.5221 2.2629 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 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 12 14 1 0 8 2 2 0 1 15 1 0 1 16 1 0 1 17 1 0 4 18 1 0 5 19 1 0 12 20 1 0 13 21 1 0 13 22 1 0 13 23 1 0 14 24 1 0 14 25 1 0 14 26 1 0 M END