HMDB0037735 RDKit 3D Isoamyl 2-furonpropionate 33 33 0 0 0 0 0 0 0 0999 V2000 -4.4244 0.9537 -0.6578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9206 -0.1310 0.2453 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3412 -1.4749 -0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4429 -0.0724 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7189 -0.2052 -0.8221 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3206 -0.1605 -0.6906 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3917 0.8842 -0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2476 1.8941 0.2178 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8664 0.9137 -0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5196 -0.3426 -0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9919 -0.1792 -0.3537 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7285 -0.5298 0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 -0.2068 0.5072 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0441 0.3338 -0.7588 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8256 0.3325 -1.2304 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 0.9811 -0.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0687 1.9530 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2445 0.7443 -1.7371 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -0.0335 1.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -1.5064 -0.3647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9732 -1.5833 -1.3465 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9281 -2.2491 0.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.9371 1.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2154 0.8619 1.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9702 -1.2125 -1.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0701 0.5238 -1.5898 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3248 1.7667 -0.5786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1622 1.0309 1.0306 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2637 -0.4986 -1.6213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1781 -1.2501 -0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3828 -0.9781 1.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9227 -0.3290 1.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8972 0.7062 -1.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 11 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 3 20 1 0 3 21 1 0 3 22 1 0 4 23 1 0 4 24 1 0 5 25 1 0 5 26 1 0 9 27 1 0 9 28 1 0 10 29 1 0 10 30 1 0 12 31 1 0 13 32 1 0 14 33 1 0 M END