HMDB0036206 RDKit 3D alpha-Amylcinnamyl formate 37 37 0 0 0 0 0 0 0 0999 V2000 4.7925 -0.1435 0.8531 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5028 0.6805 -0.3637 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2754 0.2073 -1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0489 0.2591 -0.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8701 -0.2058 -1.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3894 -0.1991 -0.2421 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3541 0.5832 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6321 0.7042 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0613 2.0336 0.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2494 2.3557 0.8508 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0456 1.3263 1.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6775 0.0215 1.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4653 -0.2752 0.4769 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5196 -1.1151 0.8962 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3232 -2.4512 0.5884 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8713 -3.2658 -0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7209 -2.8519 -1.1186 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8633 -0.4429 0.8889 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0989 -1.0105 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6273 0.5300 1.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4665 1.7760 -0.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3664 0.5765 -1.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1716 0.8224 -2.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4638 -0.8390 -1.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9332 1.3083 0.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1418 -0.4278 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1202 -1.2147 -1.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7914 0.4518 -1.9187 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1794 1.2170 -1.5484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4444 2.8657 -0.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5711 3.3905 1.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0035 1.5622 1.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2811 -0.8232 1.4065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2045 -1.3386 0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3933 -0.8486 1.5513 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.9029 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5848 -4.3158 -0.4110 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 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 6 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 13 8 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 7 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 12 33 1 0 13 34 1 0 14 35 1 0 14 36 1 0 16 37 1 0 M END