KEGG:C07053 Isoetharine ISISHOST03240423162D 1 1.00000 0.00000 6105 17 17 0 0 0 999 V2000 -0.5483 -0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0.1655 -0.7793 0.0000 C 0 0 3 0 0 0 0 0 0 -0.5483 0.4586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2586 -0.7793 0.0000 C 0 0 0 0 0 0 0 0 0 0.8828 -0.3655 0.0000 C 0 0 3 0 0 0 0 0 0 0.1690 -1.6000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.2586 0.8724 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9759 -0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 1.5966 -0.7759 0.0000 N 0 0 0 0 0 0 0 0 0 0.8828 0.4621 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9759 0.4586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2552 1.7000 0.0000 O 0 0 0 0 0 0 0 0 0 2.3138 -0.3621 0.0000 C 0 0 3 0 0 0 0 0 0 0.1655 0.8759 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6862 0.8724 0.0000 O 0 0 0 0 0 0 0 0 0 3.0276 -0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 2.3103 0.4621 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 2 0 0 0 4 8 1 0 0 0 5 9 1 0 0 0 5 10 1 0 0 0 7 11 1 0 0 0 7 12 1 0 0 0 9 13 1 0 0 0 10 14 1 0 0 0 11 15 1 0 0 0 13 16 1 0 0 0 13 17 1 0 0 0 8 11 2 0 0 0 M END