KEGG:C07118 Benzoyl acetyl-CoA ISISHOST03240423162D 1 1.00000 0.00000 6169 59 62 0 1 0 999 V2000 -0.3207 1.8000 0.0000 N 0 0 3 0 0 0 0 0 0 -0.9724 1.5897 0.0000 C 0 0 2 0 0 0 0 0 0 0.8621 1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3207 2.4897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5276 1.9966 0.0000 O 0 0 0 0 0 0 0 0 0 -1.1897 0.9448 0.0000 C 0 0 1 0 0 0 0 0 0 0.8655 2.4897 0.0000 C 0 0 0 0 0 0 0 0 0 1.4552 1.4586 0.0000 N 0 0 0 0 0 0 0 0 0 0.2724 2.8310 0.0000 N 0 0 0 0 0 0 0 0 0 -2.0828 1.5897 0.0000 C 0 0 1 0 0 0 0 0 0 -1.8724 0.9448 0.0000 C 0 0 1 0 0 0 0 0 0 -0.7828 0.3897 0.0000 O 0 0 0 0 0 0 0 0 0 1.4552 2.8276 0.0000 C 0 0 0 0 0 0 0 0 0 2.0448 1.7966 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7345 1.8035 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2241 0.4207 0.0000 O 0 0 0 0 0 0 0 0 0 2.0483 2.4862 0.0000 N 0 0 0 0 0 0 0 0 0 1.4586 3.5103 0.0000 N 0 0 0 0 0 0 0 0 0 -3.7207 1.2931 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1276 0.4207 0.0000 P 0 0 3 0 0 0 0 0 0 -4.4069 1.2931 0.0000 P 0 0 3 0 0 0 0 0 0 -3.8448 0.4207 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1276 1.2207 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1276 -0.2655 0.0000 O 0 0 0 0 0 0 0 0 0 -4.3931 -0.0828 0.0000 O 0 0 0 0 0 0 0 0 0 -4.4103 1.9793 0.0000 O 0 0 0 0 0 0 0 0 0 -5.0897 1.3000 0.0000 O 0 0 0 0 0 0 0 0 0 -4.4103 -1.3207 0.0000 P 0 0 3 0 0 0 0 0 0 -3.7241 -1.3207 0.0000 O 0 0 0 0 0 0 0 0 0 -4.4138 -2.0035 0.0000 O 0 0 0 0 0 0 0 0 0 -5.1000 -1.3207 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1345 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5414 -1.3207 0.0000 C 0 0 3 0 0 0 0 0 0 -1.9552 -0.9759 0.0000 C 0 0 3 0 0 0 0 0 0 -2.5414 -2.0035 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5448 -0.6379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3586 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9552 -0.2931 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7690 -0.9759 0.0000 N 0 0 0 0 0 0 0 0 0 -1.3586 -2.0035 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1793 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0.4103 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 1.0035 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 1.5931 -0.9759 0.0000 N 0 0 0 0 0 0 0 0 0 1.0035 -2.0035 0.0000 O 0 0 0 0 0 0 0 0 0 2.1828 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 2.7759 -0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 3.3586 -1.3138 0.0000 S 0 0 0 0 0 0 0 0 0 4.0103 -0.9586 0.0000 C 0 0 0 0 0 0 0 0 0 4.6414 -1.3345 0.0000 C 0 0 0 0 0 0 0 0 0 4.0172 -0.2276 0.0000 O 0 0 0 0 0 0 0 0 0 5.2793 -0.9724 0.0000 C 0 0 0 0 0 0 0 0 0 5.9103 -1.3483 0.0000 C 0 0 0 0 0 0 0 0 0 5.2897 -0.2414 0.0000 O 0 0 0 0 0 0 0 0 0 5.9000 -2.0793 0.0000 C 0 0 0 0 0 0 0 0 0 6.5448 -0.9862 0.0000 C 0 0 0 0 0 0 0 0 0 6.5310 -2.4552 0.0000 C 0 0 0 0 0 0 0 0 0 7.1759 -1.3621 0.0000 C 0 0 0 0 0 0 0 0 0 7.1690 -2.0931 0.0000 C 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 2 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 5 10 1 0 0 0 6 11 1 0 0 0 6 12 1 6 0 0 7 13 1 0 0 0 8 14 2 0 0 0 10 15 1 1 0 0 11 16 1 6 0 0 13 17 2 0 0 0 13 18 1 0 0 0 15 19 1 0 0 0 16 20 1 0 0 0 19 21 1 0 0 0 20 22 1 0 0 0 20 23 1 0 0 0 20 24 2 0 0 0 21 25 1 0 0 0 21 26 1 0 0 0 21 27 2 0 0 0 25 28 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 28 31 2 0 0 0 29 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 33 35 1 0 0 0 33 36 1 0 0 0 34 37 1 0 0 0 34 38 1 0 0 0 37 39 1 0 0 0 37 40 2 0 0 0 39 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 43 45 2 0 0 0 44 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 49 51 2 0 0 0 50 52 1 0 0 0 52 53 1 0 0 0 52 54 2 0 0 0 53 55 2 0 0 0 53 56 1 0 0 0 55 57 1 0 0 0 56 58 2 0 0 0 57 59 2 0 0 0 7 9 1 0 0 0 10 11 1 0 0 0 14 17 1 0 0 0 58 59 1 0 0 0 M END