KEGG:C06045 3-Methoxy-4-hydroxyphenylacetate ISISHOST03240423132D 1 1.00000 0.00000 5142 13 13 0 0 0 999 V2000 0.4621 -0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0.0897 0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0.0862 -0.6517 0.0000 C 0 0 0 0 0 0 0 0 0 1.2103 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6586 0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6621 -0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 1.5897 -0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0345 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0448 1.3035 0.0000 O 0 0 0 0 0 0 0 0 0 2.3448 -0.6483 0.0000 O 0 0 0 0 0 0 0 0 0 1.2069 -1.3000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7897 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8000 1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 2 0 0 0 3 6 1 0 0 0 4 7 1 0 0 0 5 8 1 0 0 0 5 9 1 0 0 0 7 10 1 0 0 0 7 11 2 0 0 0 8 12 1 0 0 0 9 13 1 0 0 0 6 8 2 0 0 0 M END