HMDB0029350 RDKit 3D Geranyl 3-methylbutanoate 43 42 0 0 0 0 0 0 0 0999 V2000 5.6486 1.8576 -1.2644 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7067 1.0912 -0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2355 1.7114 0.8528 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2739 -0.1185 -0.7209 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3466 -0.8228 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -1.1510 -0.5474 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1998 -1.8473 0.4524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7837 -3.1401 1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0317 -1.4254 0.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5962 -0.1791 0.3904 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.5597 -0.1942 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6655 0.4173 -0.7567 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2503 1.5946 -0.7031 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 0.0428 -1.3762 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1085 0.2843 -0.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3932 -0.1294 -1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 1.7227 -0.0269 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4683 1.6612 -2.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4455 2.9364 -1.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7158 1.6670 -0.9881 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4635 1.0814 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7687 2.6587 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 1.8470 0.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6025 -0.5942 -1.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7386 -1.8089 0.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0507 -0.2210 1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3015 -1.8469 -1.4034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6335 -0.2324 -0.9697 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5002 -2.9021 1.8072 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3561 -3.6342 0.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9697 -3.8197 1.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5093 -2.0411 1.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.4530 1.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0093 0.4450 -0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9485 -1.0033 -1.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1062 0.7418 -2.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0496 -0.3405 0.4827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5521 -1.2137 -0.9702 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2776 0.0327 -2.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2503 0.4314 -0.7131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4374 2.3693 -0.4564 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2429 1.8154 1.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2056 2.1690 -0.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 3 21 1 0 3 22 1 0 3 23 1 0 4 24 1 0 5 25 1 0 5 26 1 0 6 27 1 0 6 28 1 0 8 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 14 35 1 0 14 36 1 0 15 37 1 0 16 38 1 0 16 39 1 0 16 40 1 0 17 41 1 0 17 42 1 0 17 43 1 0 M END