HMDB0041691 RDKit 3D 5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone 28 29 0 0 0 0 0 0 0 0999 V2000 -3.2711 2.4617 1.1757 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9547 1.6337 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 0.9447 -0.7203 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0411 -0.3333 -0.9538 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6028 0.1133 -0.8045 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8459 -1.0308 -0.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5882 -0.7153 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5719 -0.9686 -0.9031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8999 -0.6385 -0.6303 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8689 -0.9130 -1.6065 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2568 -0.0579 0.5648 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6051 0.2622 0.8076 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 0.1984 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6421 0.7906 2.7221 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9763 -0.1331 1.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6548 1.1972 0.0704 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9736 1.5361 -1.6276 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7965 0.6635 -0.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2994 -1.0266 -0.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2396 -0.7658 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 0.3297 -1.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9137 -1.9045 -0.8697 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2808 -1.2804 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3008 -1.4263 -1.8492 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8358 -0.6826 -1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8363 0.6848 1.6878 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9205 0.9763 3.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2218 0.0842 1.9858 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 2 0 5 16 1 0 16 2 1 0 15 7 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 8 24 1 0 10 25 1 0 12 26 1 0 14 27 1 0 15 28 1 0 M END