HMDB0037704 RDKit 3D Isoamyl cinnamate 34 34 0 0 0 0 0 0 0 0999 V2000 -5.0536 -0.5241 -0.6385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6312 -0.2145 -0.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6151 0.8286 0.8644 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9866 -1.4734 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5756 -1.1210 0.7444 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9366 -0.6704 -0.4501 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4202 -0.2599 -0.3758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8971 -0.3460 0.7469 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0115 0.1822 -1.5916 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 0.6460 -1.6618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2197 0.8550 -0.6708 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0603 1.2022 0.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1569 1.2458 1.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 0.9391 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6187 0.5816 -0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 0.5428 -1.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4393 -1.2810 0.0879 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6726 0.3676 -0.5241 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0753 -0.9343 -1.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1014 0.1436 -1.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7904 0.3879 1.8628 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4589 1.5292 0.6516 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6347 1.3729 0.8858 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0279 -2.3222 -0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5896 -1.7502 1.2492 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0554 -2.0159 1.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5894 -0.3536 1.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4104 0.1347 -2.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5014 0.9317 -2.7385 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1147 1.5535 1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9881 1.5303 2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2649 0.9797 1.7683 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 0.3351 -0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7357 0.2549 -2.1204 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 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 11 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 3 23 1 0 4 24 1 0 4 25 1 0 5 26 1 0 5 27 1 0 9 28 1 0 10 29 1 0 12 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 16 34 1 0 M END