KEGG:C03683 6-Demethylsterigmatocystin ISISHOST03240423082D 1 1.00000 0.00000 3209 25 29 0 1 0 999 V2000 -0.0379 0.0759 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6862 -0.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0.6207 -0.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0.0034 0.7862 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9828 -0.3241 0.0000 C 0 0 1 0 0 0 0 0 0 -0.6793 -1.0621 0.0000 C 0 0 0 0 0 0 0 0 0 1.2724 0.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0.6310 -1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0.6000 1.2241 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9759 -1.0759 0.0000 C 0 0 1 0 0 0 0 0 0 -3.2793 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3241 -1.4448 0.0000 O 0 0 0 0 0 0 0 0 0 -0.0207 -1.4310 0.0000 C 0 0 0 0 0 0 0 0 0 1.2690 0.8552 0.0000 C 0 0 0 0 0 0 0 0 0 1.9276 -0.2724 0.0000 O 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 0.6069 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6241 -1.4552 0.0000 O 0 0 0 0 0 0 0 0 0 -3.2724 -1.0862 0.0000 C 0 0 0 0 0 0 0 0 0 1.9276 1.2517 0.0000 C 0 0 0 0 0 0 0 0 0 1.2379 2.3897 0.0000 C 0 0 0 0 0 0 0 0 0 1.9172 2.0207 0.0000 C 0 0 0 0 0 0 0 0 0 2.5828 0.8897 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9931 0.4310 0.0000 H 0 0 0 0 0 0 0 0 0 -1.9724 -1.8241 0.0000 H 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 1 0 0 0 5 10 1 0 0 0 5 11 1 0 0 0 6 12 1 0 0 0 6 13 1 0 0 0 7 14 1 0 0 0 7 15 2 0 0 0 8 16 1 0 0 0 9 17 1 0 0 0 10 18 1 0 0 0 11 19 2 0 0 0 14 20 1 0 0 0 17 21 2 0 0 0 20 22 2 0 0 0 20 23 1 0 0 0 8 13 2 0 0 0 9 14 2 0 0 0 10 12 1 0 0 0 18 19 1 0 0 0 21 22 1 0 0 0 5 24 1 6 0 0 10 25 1 6 0 0 M END