KEGG:C10314 Chrysophanic acid 9-anthrone ISISHOST03240423252D 1 1.00000 0.00000 9356 18 20 0 0 0 999 V2000 0.5517 -0.6448 0.0000 C 0 0 0 0 0 0 0 0 0 0.5586 0.1828 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1655 -1.0552 0.0000 C 0 0 0 0 0 0 0 0 0 1.2655 -1.0621 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1586 0.6034 0.0000 C 0 0 0 0 0 0 0 0 0 1.2793 0.5931 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8828 -0.6379 0.0000 C 0 0 0 0 0 0 0 0 0 1.9862 -0.6552 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8793 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1552 1.4310 0.0000 O 0 0 0 0 0 0 0 0 0 1.9931 0.1690 0.0000 C 0 0 0 0 0 0 0 0 0 1.2862 1.4207 0.0000 O 0 0 0 0 0 0 0 0 0 -1.5897 -1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 2.7000 -1.0759 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5897 0.6069 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3103 -0.6379 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3103 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5897 1.4345 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 1 0 0 0 5 10 2 0 0 0 6 11 2 0 0 0 6 12 1 0 0 0 7 13 1 0 0 0 8 14 1 0 0 0 9 15 1 0 0 0 13 16 2 0 0 0 15 17 2 0 0 0 15 18 1 0 0 0 7 9 2 0 0 0 8 11 1 0 0 0 16 17 1 0 0 0 M END