KEGG:C01198 3-(2-Hydroxyphenyl)propanoate ISISHOST03240423032D 1 1.00000 0.00000 1126 12 12 0 0 0 999 V2000 -0.3103 0.1103 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6828 0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0.4414 0.1103 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6862 -0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4448 0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3103 1.4138 0.0000 O 0 0 0 0 0 0 0 0 0 0.8138 -0.5414 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4379 -0.5517 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8207 0.1000 0.0000 C 0 0 0 0 0 0 0 0 0 1.5655 -0.5414 0.0000 C 0 0 0 0 0 0 0 0 0 1.9379 -1.1931 0.0000 O 0 0 0 0 0 0 0 0 0 1.9379 0.1103 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 4 8 2 0 0 0 5 9 2 0 0 0 7 10 1 0 0 0 10 11 1 0 0 0 10 12 2 0 0 0 8 9 1 0 0 0 M END