KEGG:C08558 Tuberonic acid glucoside ISISHOST03240423202D 1 1.00000 0.00000 7598 27 28 0 0 0 999 V2000 3.3069 0.2724 0.0000 C 0 0 2 0 0 0 0 0 0 3.3966 -0.5310 0.0000 C 0 0 2 0 0 0 0 0 0 4.0517 0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 2.6103 0.6793 0.0000 C 0 0 0 0 0 0 0 0 0 4.1862 -0.6966 0.0000 C 0 0 0 0 0 0 0 0 0 2.6931 -0.9345 0.0000 C 0 0 0 0 0 0 0 0 0 4.5931 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 4.2207 1.3966 0.0000 O 0 0 0 0 0 0 0 0 0 1.9069 0.2724 0.0000 C 0 0 0 0 0 0 0 0 0 1.9966 -0.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0.9103 0.2759 0.0000 C 0 0 0 0 0 0 0 0 0 1.1862 -0.9897 0.0000 O 0 0 0 0 0 0 0 0 0 1.1379 -0.2552 0.0000 O 0 0 0 0 0 0 0 0 0 0.1793 0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5931 0.3586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3172 0.8276 0.0000 O 0 0 0 0 0 0 0 0 0 -2.1310 0.4414 0.0000 C 0 0 2 0 0 0 0 0 0 -2.8207 0.8414 0.0000 O 0 0 0 0 0 0 0 0 0 -2.1310 -0.3586 0.0000 C 0 0 1 0 0 0 0 0 0 -3.5103 0.4414 0.0000 C 0 0 1 0 0 0 0 0 0 -2.8207 -0.7483 0.0000 C 0 0 2 0 0 0 0 0 0 -1.4414 -0.7483 0.0000 O 0 0 0 0 0 0 0 0 0 -3.5103 -0.3586 0.0000 C 0 0 2 0 0 0 0 0 0 -4.1966 0.8414 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8172 -1.5448 0.0000 O 0 0 0 0 0 0 0 0 0 -4.1966 -0.7483 0.0000 O 0 0 0 0 0 0 0 0 0 -4.8862 0.4448 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 1 0 0 2 5 1 0 0 0 2 6 1 6 0 0 3 7 1 0 0 0 3 8 2 0 0 0 4 9 1 0 0 0 6 10 1 0 0 0 9 11 2 0 0 0 10 12 1 0 0 0 10 13 2 0 0 0 11 14 1 0 0 0 14 15 1 0 0 0 15 16 1 0 0 0 17 16 1 1 0 0 17 18 1 0 0 0 17 19 1 0 0 0 18 20 1 0 0 0 19 21 1 0 0 0 19 22 1 6 0 0 20 23 1 0 0 0 20 24 1 1 0 0 21 25 1 1 0 0 23 26 1 6 0 0 24 27 1 0 0 0 5 7 1 0 0 0 21 23 1 0 0 0 M END