KEGG:C04360 1-O,2-O,6-O-Trigalloyl-beta-D-glucose ISISHOST03240423102D 1 1.00000 0.00000 3776 45 48 0 1 0 999 V2000 0.0414 -0.0793 0.0000 C 0 0 1 0 0 0 0 0 0 0.0414 -0.8379 0.0000 C 0 0 1 0 0 0 0 0 0 -0.6172 0.2966 0.0000 O 0 0 0 0 0 0 0 0 0 0.6897 0.2966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.6172 -1.2207 0.0000 C 0 0 2 0 0 0 0 0 0 0.6931 -1.2138 0.0000 O 0 0 0 0 0 0 0 0 0 -1.2655 -0.0793 0.0000 C 0 0 1 0 0 0 0 0 0 1.0724 0.9448 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2655 -0.8379 0.0000 C 0 0 1 0 0 0 0 0 0 -0.6207 -1.9724 0.0000 O 0 0 0 0 0 0 0 0 0 1.3448 -1.5828 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9172 0.2966 0.0000 C 0 0 0 0 0 0 0 0 0 1.8207 0.9345 0.0000 C 0 0 0 0 0 0 0 0 0 0.7069 1.6000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9172 -1.2103 0.0000 O 0 0 0 0 0 0 0 0 0 1.3448 -2.3345 0.0000 C 0 0 0 0 0 0 0 0 0 1.9931 -1.2103 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9138 1.0414 0.0000 O 0 0 0 0 0 0 0 0 0 2.1862 0.2793 0.0000 C 0 0 0 0 0 0 0 0 0 2.2069 1.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0.6966 -2.7103 0.0000 C 0 0 0 0 0 0 0 0 0 2.0035 -2.7103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9138 1.7931 0.0000 C 0 0 0 0 0 0 0 0 0 2.9448 0.2655 0.0000 C 0 0 0 0 0 0 0 0 0 2.9655 1.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0.6966 -3.4690 0.0000 C 0 0 0 0 0 0 0 0 0 2.0035 -3.4690 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5655 2.1655 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2655 2.1724 0.0000 O 0 0 0 0 0 0 0 0 0 3.3379 0.9103 0.0000 C 0 0 0 0 0 0 0 0 0 3.3069 -0.3897 0.0000 O 0 0 0 0 0 0 0 0 0 3.3483 2.2172 0.0000 O 0 0 0 0 0 0 0 0 0 1.3448 -3.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0.0448 -3.8379 0.0000 O 0 0 0 0 0 0 0 0 0 2.6552 -3.8414 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5655 2.9138 0.0000 C 0 0 0 0 0 0 0 0 0 -3.2172 1.7828 0.0000 C 0 0 0 0 0 0 0 0 0 4.0862 0.8966 0.0000 O 0 0 0 0 0 0 0 0 0 1.3448 -4.6000 0.0000 O 0 0 0 0 0 0 0 0 0 -3.2241 3.2931 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8759 2.1586 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8793 2.9207 0.0000 C 0 0 0 0 0 0 0 0 0 -3.2207 4.0414 0.0000 O 0 0 0 0 0 0 0 0 0 -4.5241 1.7828 0.0000 O 0 0 0 0 0 0 0 0 0 -4.5276 3.2966 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 4 8 1 0 0 0 5 9 1 0 0 0 5 10 1 1 0 0 6 11 1 0 0 0 7 12 1 1 0 0 8 13 1 0 0 0 8 14 2 0 0 0 9 15 1 6 0 0 11 16 1 0 0 0 11 17 2 0 0 0 12 18 1 0 0 0 13 19 2 0 0 0 13 20 1 0 0 0 16 21 2 0 0 0 16 22 1 0 0 0 18 23 1 0 0 0 19 24 1 0 0 0 20 25 2 0 0 0 21 26 1 0 0 0 22 27 2 0 0 0 23 28 1 0 0 0 23 29 2 0 0 0 24 30 2 0 0 0 24 31 1 0 0 0 25 32 1 0 0 0 26 33 2 0 0 0 26 34 1 0 0 0 27 35 1 0 0 0 28 36 2 0 0 0 28 37 1 0 0 0 30 38 1 0 0 0 33 39 1 0 0 0 36 40 1 0 0 0 37 41 2 0 0 0 40 42 2 0 0 0 40 43 1 0 0 0 41 44 1 0 0 0 42 45 1 0 0 0 7 9 1 0 0 0 25 30 1 0 0 0 27 33 1 0 0 0 41 42 1 0 0 0 M END