HMDB0302214 RDKit 3D Salicylates 15 15 0 0 0 0 0 0 0 0999 V2000 2.4157 1.7621 -0.2366 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 0.5765 -0.0884 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -0.4035 0.0266 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6171 0.2707 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1983 -1.0452 0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1434 -1.3727 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0468 -0.3398 0.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 0.9759 -0.1161 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 1.2744 -0.1607 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0654 2.6102 -0.3273 O 0 0 0 0 0 1 0 0 0 0 0 0 2.8807 -1.2572 -0.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9084 -1.8543 0.2174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4648 -2.4162 0.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1031 -0.5549 0.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3905 1.7739 -0.2101 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 4 1 0 3 11 1 0 5 12 1 0 6 13 1 0 7 14 1 0 8 15 1 0 M CHG 1 10 -1 M END