KEGG:C08539 Betanidin ISISHOST03240423202D 1 1.00000 0.00000 7579 28 30 0 0 0 999 V2000 -0.7759 1.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0.0069 1.1897 0.0000 N 0 3 0 0 0 0 0 0 0 -0.7690 2.2724 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4966 1.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 1.8552 0.0000 C 0 0 1 0 0 0 0 0 0 0.0069 0.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0.0172 2.5276 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4793 2.6931 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2034 1.4621 0.0000 C 0 0 0 0 0 0 0 0 0 1.3276 1.8586 0.0000 C 0 0 0 0 0 0 0 0 0 0.7241 -0.0586 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1966 2.2862 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9241 1.0586 0.0000 O 0 0 0 0 0 0 0 0 0 1.7414 2.5759 0.0000 O 0 0 0 0 0 0 0 0 0 1.7414 1.1379 0.0000 O 0 5 0 0 0 0 0 0 0 0.7241 -0.8897 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9069 2.7103 0.0000 O 0 0 0 0 0 0 0 0 0 0.0034 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 1.4414 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0.0034 -2.1310 0.0000 C 0 0 2 0 0 0 0 0 0 1.4414 -2.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0.7241 -2.5483 0.0000 N 0 0 0 0 0 0 0 0 0 -0.7138 -2.5483 0.0000 C 0 0 0 0 0 0 0 0 0 2.1586 -2.5483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4345 -2.1310 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7138 -3.3759 0.0000 O 0 0 0 0 0 0 0 0 0 2.1586 -3.3759 0.0000 O 0 0 0 0 0 0 0 0 0 2.8793 -2.1310 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 5 10 1 1 0 0 6 11 1 0 0 0 8 12 2 0 0 0 9 13 1 0 0 0 10 14 2 0 0 0 10 15 1 0 0 0 11 16 2 0 0 0 12 17 1 0 0 0 16 18 1 0 0 0 16 19 1 0 0 0 18 20 1 0 0 0 19 21 2 0 0 0 20 22 1 0 0 0 20 23 1 6 0 0 21 24 1 0 0 0 23 25 1 0 0 0 23 26 2 0 0 0 24 27 1 0 0 0 24 28 2 0 0 0 5 7 1 0 0 0 9 12 1 0 0 0 21 22 1 0 0 0 M CHG 2 2 1 15 -1 M END