HMDB0059999 RDKit 3D Gentisuric acid 24 24 0 0 0 0 0 0 0 0999 V2000 -3.0973 1.0152 -0.3238 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4735 0.0474 -1.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8098 -0.2014 -1.2343 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -0.8548 -1.6665 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1255 -0.4625 -1.3589 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6325 -0.4064 -0.0292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4982 -0.7337 0.8448 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7239 -0.0168 0.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6155 0.3285 -0.6852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 0.7075 -0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7962 1.0501 -1.4434 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2944 0.7298 0.8936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4536 0.3992 1.9213 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1155 0.0096 1.6411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3145 -0.3110 2.6989 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3607 0.1625 -2.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6886 -0.8190 -2.7576 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6957 -1.9027 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5079 -0.2175 -2.1425 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 0.3053 -1.7274 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3825 0.3255 -1.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3183 1.0276 1.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7474 0.4151 2.9588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 -0.5972 2.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 14 8 1 0 3 16 1 0 4 17 1 0 4 18 1 0 5 19 1 0 9 20 1 0 11 21 1 0 12 22 1 0 13 23 1 0 15 24 1 0 M END