KEGG:C03344 2-Methylacetoacetyl-CoA ISISHOST03240423082D 1 1.00000 0.00000 2932 55 57 0 1 0 999 V2000 0.5034 2.8276 0.0000 N 0 0 3 0 0 0 0 0 0 0.1931 1.5276 0.0000 C 0 0 1 0 0 0 0 0 0 -0.8069 2.8276 0.0000 C 0 0 0 0 0 0 0 0 0 0.5069 3.5862 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0345 0.8207 0.0000 C 0 0 1 0 0 0 0 0 0 -0.4276 1.9759 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8069 3.5862 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4655 2.4448 0.0000 N 0 0 0 0 0 0 0 0 0 -0.1517 3.9690 0.0000 N 0 0 0 0 0 0 0 0 0 -0.8000 0.8207 0.0000 C 0 0 1 0 0 0 0 0 0 0.4069 0.2138 0.0000 O 0 0 0 0 0 0 0 0 0 -1.0379 1.5379 0.0000 C 0 0 1 0 0 0 0 0 0 -1.4655 3.9621 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1138 2.8276 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1828 0.2828 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7414 1.7586 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1138 3.5862 0.0000 N 0 0 0 0 0 0 0 0 0 -1.4655 4.7138 0.0000 N 0 0 0 0 0 0 0 0 0 -1.9828 0.2897 0.0000 P 0 0 3 0 0 0 0 0 0 -2.7655 1.2724 0.0000 O 0 0 0 0 0 0 0 0 0 -2.0000 1.0035 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7138 0.2690 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9862 -0.4655 0.0000 O 0 0 0 0 0 0 0 0 0 -3.9621 1.2586 0.0000 P 0 0 3 0 0 0 0 0 0 -3.9621 -0.3276 0.0000 O 0 0 0 0 0 0 0 0 0 -3.9552 2.0172 0.0000 O 0 0 0 0 0 0 0 0 0 -4.7172 1.2724 0.0000 O 0 0 0 0 0 0 0 0 0 -3.9586 -1.8586 0.0000 P 0 0 3 0 0 0 0 0 0 -3.1759 -1.8414 0.0000 O 0 0 0 0 0 0 0 0 0 -3.9724 -2.7448 0.0000 O 0 0 0 0 0 0 0 0 0 -4.7103 -1.8448 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5310 -1.4690 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8793 -1.8448 0.0000 C 0 0 3 0 0 0 0 0 0 -0.9172 -1.5483 0.0000 C 0 0 3 0 0 0 0 0 0 -1.8897 -2.5103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8966 -1.0690 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2690 -1.9207 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9172 -0.7966 0.0000 O 0 0 0 0 0 0 0 0 0 0.3793 -1.5483 0.0000 N 0 0 0 0 0 0 0 0 0 -0.2690 -2.6724 0.0000 O 0 0 0 0 0 0 0 0 0 1.0310 -1.9207 0.0000 C 0 0 0 0 0 0 0 0 0 1.6793 -1.5483 0.0000 C 0 0 0 0 0 0 0 0 0 2.3276 -1.9207 0.0000 C 0 0 0 0 0 0 0 0 0 2.9793 -1.5483 0.0000 N 0 0 0 0 0 0 0 0 0 2.3276 -2.6724 0.0000 O 0 0 0 0 0 0 0 0 0 3.6276 -1.9207 0.0000 C 0 0 0 0 0 0 0 0 0 4.2759 -1.5483 0.0000 C 0 0 0 0 0 0 0 0 0 4.9276 -1.9207 0.0000 S 0 0 0 0 0 0 0 0 0 5.5759 -1.5448 0.0000 C 0 0 0 0 0 0 0 0 0 6.2241 -1.9207 0.0000 C 0 0 3 0 0 0 0 0 0 5.5759 -0.7966 0.0000 O 0 0 0 0 0 0 0 0 0 6.8759 -1.5448 0.0000 C 0 0 0 0 0 0 0 0 0 6.2276 -2.6724 0.0000 C 0 0 0 0 0 0 0 0 0 7.5241 -1.9207 0.0000 C 0 0 0 0 0 0 0 0 0 6.8759 -0.7966 0.0000 O 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 5 11 1 6 0 0 6 12 1 0 0 0 7 13 1 0 0 0 8 14 2 0 0 0 10 15 1 6 0 0 12 16 1 1 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 19 22 1 0 0 0 19 23 2 0 0 0 20 24 1 0 0 0 24 25 1 0 0 0 24 26 1 0 0 0 24 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 50 53 1 0 0 0 52 54 1 0 0 0 52 55 2 0 0 0 7 9 1 0 0 0 10 12 1 0 0 0 14 17 1 0 0 0 M END