KEGG:C07350 3-Methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one ISISHOST03240423172D 1 1.00000 0.00000 6398 15 15 0 0 0 999 V2000 -0.2379 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0.4759 -0.4379 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2379 0.7966 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9517 -0.4414 0.0000 C 0 0 0 0 0 0 0 0 0 1.1897 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0.4793 -1.2621 0.0000 O 0 0 0 0 0 0 0 0 0 -0.9517 1.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0.4759 1.2103 0.0000 O 0 0 0 0 0 0 0 0 0 -1.6655 -0.0310 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9483 -1.2655 0.0000 O 0 0 0 0 0 0 0 0 0 1.9035 -0.4379 0.0000 C 0 0 3 0 0 0 0 0 0 -1.6655 0.7966 0.0000 C 0 0 0 0 0 0 0 0 0 2.6138 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 1.9035 -1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3828 1.2069 0.0000 O 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 1 0 0 0 2 6 2 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 4 10 1 0 0 0 5 11 1 0 0 0 7 12 2 0 0 0 11 13 1 0 0 0 11 14 1 0 0 0 12 15 1 0 0 0 9 12 1 0 0 0 M END