HMDB0037274 RDKit 3D Maltol propionate 23 23 0 0 0 0 0 0 0 0999 V2000 3.6632 0.0724 -0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6961 -0.4514 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3223 0.0078 0.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8992 0.9589 1.3178 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4058 -0.4550 -0.3367 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8948 0.0678 -0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9557 -0.5491 0.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6491 -1.7737 0.9717 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1603 -0.0464 0.0887 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4377 1.0338 -0.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4279 1.7041 -1.2544 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 1.2105 -1.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1685 1.7628 -1.7418 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 0.9988 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 0.2606 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7769 -0.7519 -1.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8282 -1.5549 0.8334 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0585 -0.0746 1.7759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7731 -1.6739 1.6128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.5567 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5086 -2.1872 1.5209 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4697 1.3987 -0.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5959 2.5986 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 6 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 8 19 1 0 8 20 1 0 8 21 1 0 10 22 1 0 11 23 1 0 M END