KEGG:C08789 Bryodulcosigenin ISISHOST03240423212D 1 1.00000 0.00000 7829 37 40 0 0 0 999 V2000 -0.4759 -0.8000 0.0000 C 0 0 1 0 0 0 0 0 0 0.2241 -0.4000 0.0000 C 0 0 1 0 0 0 0 0 0 -1.1759 -0.3931 0.0000 C 0 0 2 0 0 0 0 0 0 -0.4759 -1.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0.2345 0.4069 0.0000 C 0 0 1 0 0 0 0 0 0 1.6241 -0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0.2172 -1.2103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8793 -0.7931 0.0000 C 0 0 1 0 0 0 0 0 0 -1.1690 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1828 -1.2034 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1828 -2.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0.9414 0.8034 0.0000 C 0 0 2 0 0 0 0 0 0 -0.4621 0.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0.2276 1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 1.6345 0.3897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8828 -1.6069 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5828 -0.3897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8690 0.8310 0.0000 O 0 0 0 0 0 0 0 0 0 0.9379 1.6138 0.0000 C 0 0 1 0 0 0 0 0 0 -2.5828 -2.0138 0.0000 C 0 0 3 0 0 0 0 0 0 -3.2862 -0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 1.6345 2.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0.2276 2.0172 0.0000 C 0 0 0 0 0 0 0 0 0 -3.2862 -1.6069 0.0000 C 0 0 2 0 0 0 0 0 0 -2.1828 -2.7138 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9966 -2.7138 0.0000 C 0 0 0 0 0 0 0 0 0 2.3379 1.6172 0.0000 C 0 0 0 0 0 0 0 0 0 -3.9931 -2.0103 0.0000 O 0 0 0 0 0 0 0 0 0 3.0379 2.0241 0.0000 C 0 0 3 0 0 0 0 0 0 3.7379 1.6241 0.0000 C 0 0 3 0 0 0 0 0 0 3.0345 2.8345 0.0000 O 0 0 0 0 0 0 0 0 0 4.4414 2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 4.4414 1.2138 0.0000 C 0 0 0 0 0 0 0 0 0 3.7345 0.8103 0.0000 O 0 0 0 0 0 0 0 0 0 -0.4828 0.0241 0.0000 H 0 0 0 0 0 0 0 0 0 -1.8862 0.0345 0.0000 H 0 0 0 0 0 0 0 0 0 1.6483 1.2207 0.0000 H 0 0 0 0 0 0 0 0 0 1 2 1 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 2 7 1 6 0 0 3 8 1 0 0 0 3 9 1 0 0 0 3 10 1 1 0 0 4 11 1 0 0 0 5 12 1 0 0 0 5 13 1 0 0 0 5 14 1 1 0 0 6 15 1 0 0 0 8 16 1 0 0 0 8 17 1 0 0 0 9 18 2 0 0 0 12 19 1 0 0 0 16 20 1 0 0 0 17 21 1 0 0 0 19 22 1 0 0 0 19 23 1 6 0 0 20 24 1 0 0 0 20 25 1 0 0 0 20 26 1 0 0 0 22 27 1 0 0 0 24 28 1 1 0 0 27 29 1 0 0 0 29 30 1 0 0 0 29 31 1 4 0 0 30 32 1 0 0 0 30 33 1 0 0 0 30 34 1 0 0 0 9 13 1 0 0 0 11 16 2 0 0 0 12 15 1 0 0 0 21 24 1 0 0 0 1 35 1 1 0 0 8 36 1 6 0 0 12 37 1 6 0 0 M END