KEGG:C07302 3-Hydroxy-3-(3-hydroxy-4-methoxyphenyl)propionyl-CoA ISISHOST03240423162D 1 1.00000 0.00000 6351 62 65 0 1 0 999 V2000 -0.3724 3.0552 0.0000 N 0 0 3 0 0 0 0 0 0 -0.6172 1.5035 0.0000 C 0 0 2 0 0 0 0 0 0 -1.5276 3.0552 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3655 3.7207 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1621 1.8966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8172 0.8793 0.0000 C 0 0 1 0 0 0 0 0 0 -1.5276 3.7207 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1103 2.7138 0.0000 N 0 0 0 0 0 0 0 0 0 -0.9483 4.0586 0.0000 N 0 0 0 0 0 0 0 0 0 -1.7069 1.5103 0.0000 C 0 0 1 0 0 0 0 0 0 -1.4931 0.8793 0.0000 C 0 0 1 0 0 0 0 0 0 -0.4276 0.3448 0.0000 O 0 0 0 0 0 0 0 0 0 -2.1103 4.0517 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6828 3.0552 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3241 1.7069 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8345 0.4034 0.0000 O 0 0 0 0 0 0 0 0 0 -2.6828 3.7207 0.0000 N 0 0 0 0 0 0 0 0 0 -2.1103 4.7138 0.0000 N 0 0 0 0 0 0 0 0 0 -3.2345 1.2793 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5379 0.4069 0.0000 P 0 0 3 0 0 0 0 0 0 -4.2931 1.2655 0.0000 P 0 0 3 0 0 0 0 0 0 -2.4897 1.0379 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1897 0.3931 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5310 -0.1621 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2931 -0.1379 0.0000 O 0 0 0 0 0 0 0 0 0 -4.3000 1.9138 0.0000 O 0 0 0 0 0 0 0 0 0 -4.9552 1.2793 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2862 -1.4897 0.0000 P 0 0 3 0 0 0 0 0 0 -3.5483 -1.4897 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2966 -2.2724 0.0000 O 0 0 0 0 0 0 0 0 0 -4.9000 -1.4931 0.0000 O 0 0 0 0 0 0 0 0 0 -3.0241 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4517 -1.4759 0.0000 C 0 0 3 0 0 0 0 0 0 -1.8759 -1.1448 0.0000 C 0 0 3 0 0 0 0 0 0 -2.4621 -1.9966 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4586 -0.6966 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3000 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8759 -0.4828 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7276 -1.1448 0.0000 N 0 0 0 0 0 0 0 0 0 -1.3000 -2.1379 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1552 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0.4207 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0.9931 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 1.5690 -1.1448 0.0000 N 0 0 0 0 0 0 0 0 0 0.9931 -2.1379 0.0000 O 0 0 0 0 0 0 0 0 0 2.1448 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 2.7172 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 3.2931 -1.4759 0.0000 S 0 0 0 0 0 0 0 0 0 3.8655 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 4.4379 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 3.8655 -0.4793 0.0000 O 0 0 0 0 0 0 0 0 0 5.0172 -1.1448 0.0000 C 0 0 3 0 0 0 0 0 0 5.5931 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 5.0172 -0.4793 0.0000 O 0 0 0 0 0 0 0 0 0 6.1690 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 5.5897 -2.1414 0.0000 C 0 0 0 0 0 0 0 0 0 6.7448 -1.4759 0.0000 C 0 0 0 0 0 0 0 0 0 6.1655 -2.4759 0.0000 C 0 0 0 0 0 0 0 0 0 6.7448 -2.1414 0.0000 C 0 0 0 0 0 0 0 0 0 7.3207 -1.1448 0.0000 O 0 0 0 0 0 0 0 0 0 7.3207 -2.4759 0.0000 O 0 0 0 0 0 0 0 0 0 7.3172 -3.1414 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 1 0 0 0 53 55 1 0 0 0 53 56 2 0 0 0 55 57 2 0 0 0 56 58 1 0 0 0 57 59 1 0 0 0 57 60 1 0 0 0 59 61 1 0 0 0 61 62 1 0 0 0 7 9 1 0 0 0 10 11 1 0 0 0 14 17 1 0 0 0 58 59 2 0 0 0 M END