KEGG:C11653 Iridotrial glucoside ISISHOST03240423292D 1 1.00000 0.00000 12653 26 28 0 1 0 999 V2000 1.2483 -2.6369 0.0000 O 0 0 0 0 0 0 0 0 0 0.4177 -3.2658 0.0000 C 0 0 2 0 0 0 0 0 0 -0.2878 -2.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0.4133 -4.0885 0.0000 C 0 0 1 0 0 0 0 0 0 -1.0048 -3.2574 0.0000 C 0 0 1 0 0 0 0 0 0 -0.3025 -4.4930 0.0000 C 0 0 2 0 0 0 0 0 0 1.1218 -4.5048 0.0000 O 0 0 0 0 0 0 0 0 0 -1.0121 -4.0784 0.0000 C 0 0 2 0 0 0 0 0 0 -1.7102 -2.8428 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3068 -5.3157 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7249 -4.4847 0.0000 O 0 0 0 0 0 0 0 0 0 -2.4192 -3.2461 0.0000 O 0 0 0 0 0 0 0 0 0 0.5414 -1.4057 0.0000 C 0 0 2 0 0 0 0 0 0 0.5414 -0.5865 0.0000 C 0 0 1 0 0 0 0 0 0 1.2503 -1.8189 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2372 -1.6533 0.0000 C 0 0 2 0 0 0 0 0 0 1.2503 -0.1768 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2372 -0.3348 0.0000 C 0 0 0 0 0 0 0 0 0 1.9593 -1.4092 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7116 -0.9927 0.0000 C 0 0 0 0 0 0 0 0 0 1.9593 -0.5865 0.0000 C 0 0 0 0 0 0 0 0 0 1.2503 0.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0.5414 1.0555 0.0000 O 0 0 0 0 0 0 0 0 0 0.5345 -2.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0.5345 0.2328 0.0000 H 0 0 0 0 0 0 0 0 0 -0.9542 -2.0583 0.0000 C 0 0 0 0 0 0 0 0 0 4 6 1 0 0 0 4 7 1 6 0 0 5 8 1 0 0 0 5 9 1 1 0 0 6 10 1 1 0 0 8 11 1 6 0 0 6 8 1 0 0 0 9 12 1 0 0 0 2 1 1 1 0 0 2 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 13 16 1 0 0 0 14 17 1 0 0 0 14 18 1 0 0 0 15 19 1 0 0 0 16 20 1 0 0 0 17 21 2 0 0 0 17 22 1 0 0 0 22 23 2 0 0 0 18 20 1 0 0 0 19 21 1 0 0 0 13 24 1 1 0 0 14 25 1 1 0 0 15 1 1 1 0 0 16 26 1 1 0 0 M END