KEGG:C04013 Multi-methyl-branched acyl-CoA ISISHOST03240423092D 1 1.00000 0.00000 3477 54 56 0 1 0 999 V2000 0.1448 3.2069 0.0000 N 0 0 3 0 0 0 0 0 0 -0.1276 1.4862 0.0000 C 0 0 1 0 0 0 0 0 0 -1.1345 3.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0.1517 3.9448 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3483 0.7966 0.0000 C 0 0 1 0 0 0 0 0 0 -0.7345 1.9276 0.0000 O 0 0 0 0 0 0 0 0 0 -1.1345 3.9448 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7793 2.8310 0.0000 N 0 0 0 0 0 0 0 0 0 -0.4931 4.3172 0.0000 N 0 0 0 0 0 0 0 0 0 -1.1000 0.7966 0.0000 C 0 0 1 0 0 0 0 0 0 0.0828 0.2000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3345 1.4966 0.0000 C 0 0 1 0 0 0 0 0 0 -1.7793 4.3172 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4172 3.2069 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4759 0.2690 0.0000 O 0 0 0 0 0 0 0 0 0 -2.0207 1.7138 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4172 3.9448 0.0000 N 0 0 0 0 0 0 0 0 0 -1.7828 5.0517 0.0000 N 0 0 0 0 0 0 0 0 0 -2.2621 0.2724 0.0000 P 0 0 3 0 0 0 0 0 0 -3.0276 1.2414 0.0000 O 0 0 0 0 0 0 0 0 0 -2.2034 0.9724 0.0000 O 0 0 0 0 0 0 0 0 0 -2.9793 0.2552 0.0000 O 0 0 0 0 0 0 0 0 0 -2.2759 -0.3241 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2034 1.2276 0.0000 P 0 0 3 0 0 0 0 0 0 -4.2034 -0.3345 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2138 1.9448 0.0000 O 0 0 0 0 0 0 0 0 0 -4.9448 1.2379 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2000 -1.8310 0.0000 P 0 0 3 0 0 0 0 0 0 -3.3793 -1.8310 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2138 -2.7000 0.0000 O 0 0 0 0 0 0 0 0 0 -4.8793 -1.8345 0.0000 O 0 0 0 0 0 0 0 0 0 -2.8000 -1.4483 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1586 -1.8172 0.0000 C 0 0 3 0 0 0 0 0 0 -1.2414 -1.4414 0.0000 C 0 0 3 0 0 0 0 0 0 -2.1552 -2.3862 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1655 -1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6034 -1.8103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2414 -0.7069 0.0000 O 0 0 0 0 0 0 0 0 0 0.0345 -1.4414 0.0000 N 0 0 0 0 0 0 0 0 0 -0.6034 -2.5483 0.0000 O 0 0 0 0 0 0 0 0 0 0.6724 -1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 1.3069 -1.4414 0.0000 C 0 0 0 0 0 0 0 0 0 1.9448 -1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 2.5828 -1.4414 0.0000 N 0 0 0 0 0 0 0 0 0 1.9448 -2.5483 0.0000 O 0 0 0 0 0 0 0 0 0 3.2207 -1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 3.8552 -1.4414 0.0000 C 0 0 0 0 0 0 0 0 0 4.4966 -1.8069 0.0000 S 0 0 0 0 0 0 0 0 0 5.1310 -1.4414 0.0000 C 0 0 0 0 0 0 0 0 0 5.8897 -1.8069 0.0000 C 0 0 3 0 0 0 0 0 0 5.1310 -0.7069 0.0000 O 0 0 0 0 0 0 0 0 0 6.6966 -1.4379 0.0000 C 0 0 0 0 0 0 0 0 0 5.8897 -2.5483 0.0000 C 0 0 0 0 0 0 0 0 0 7.3310 -1.8069 0.0000 R 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 7 9 1 0 0 0 10 12 1 0 0 0 14 17 1 0 0 0 M STY 1 1 SRU M SLB 1 1 1 M SCN 1 1 HT M SAL 1 2 50 53 M SBL 1 2 49 51 M SDI 1 4 5.5034 -2.0241 5.5034 -1.2103 M SDI 1 4 6.2586 -1.2103 6.2586 -2.0241 M END