KEGG:C10484 Phenethyl caffeate ISISHOST03240423252D 1 1.00000 0.00000 9526 21 22 0 0 0 999 V2000 9.7861 -5.0204 0.0000 C 0 0 0 0 0 0 0 0 0 9.0636 -5.4285 0.0000 C 0 0 0 0 0 0 0 0 0 9.7899 -4.1954 0.0000 C 0 0 0 0 0 0 0 0 0 10.5002 -5.4388 0.0000 C 0 0 0 0 0 0 0 0 0 9.0610 -6.2582 0.0000 C 0 0 0 0 0 0 0 0 0 10.5108 -3.7904 0.0000 C 0 0 0 0 0 0 0 0 0 10.4947 -6.2669 0.0000 C 0 0 0 0 0 0 0 0 0 9.7751 -6.6765 0.0000 C 0 0 0 0 0 0 0 0 0 10.5163 -2.9624 0.0000 C 0 0 0 0 0 0 0 0 0 9.7713 -7.5016 0.0000 O 0 0 0 0 0 0 0 0 0 9.8039 -2.5412 0.0000 O 0 0 0 0 0 0 0 0 0 11.2388 -2.5545 0.0000 O 0 0 0 0 0 0 0 0 0 11.9493 -2.9739 0.0000 C 0 0 0 0 0 0 0 0 0 12.6677 -2.5682 0.0000 C 0 0 0 0 0 0 0 0 0 11.2065 -6.6839 0.0000 O 0 0 0 0 0 0 0 0 0 13.3782 -2.9876 0.0000 C 0 0 0 0 0 0 0 0 0 13.3668 -3.8124 0.0000 C 0 0 0 0 0 0 0 0 0 14.0772 -4.2318 0.0000 C 0 0 0 0 0 0 0 0 0 14.7956 -3.8262 0.0000 C 0 0 0 0 0 0 0 0 0 14.8036 -3.0012 0.0000 C 0 0 0 0 0 0 0 0 0 14.0931 -2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 8 10 1 0 0 0 9 11 2 0 0 0 9 12 1 0 0 0 7 8 2 0 0 0 12 13 1 0 0 0 1 2 1 0 0 0 13 14 1 0 0 0 1 3 1 0 0 0 7 15 1 0 0 0 1 4 2 0 0 0 14 16 1 0 0 0 2 5 2 0 0 0 3 6 2 0 0 0 4 7 1 0 0 0 5 8 1 0 0 0 6 9 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 19 20 1 0 0 0 20 21 2 0 0 0 21 16 1 0 0 0 M END