KEGG:C11456 cis-3-(1-Carboxy-ethyl)-3,5-cyclo-hexadiene-1,2-diol ISISHOST03240423282D 1 1.00000 0.00000 11771 13 13 0 1 0 999 V2000 1.5875 -6.7917 0.0000 C 0 0 0 0 0 0 0 0 0 1.5875 -7.6208 0.0000 C 0 0 0 0 0 0 0 0 0 2.3079 -8.0333 0.0000 C 0 0 0 0 0 0 0 0 0 3.0240 -7.6208 0.0000 C 0 0 1 0 0 0 0 0 0 3.0240 -6.7917 0.0000 C 0 0 1 0 0 0 0 0 0 2.3079 -6.3750 0.0000 C 0 0 0 0 0 0 0 0 0 3.7430 -6.3755 0.0000 O 0 0 0 0 0 0 0 0 0 3.7430 -8.0328 0.0000 O 0 0 0 0 0 0 0 0 0 2.3089 -5.5458 0.0000 C 0 0 3 0 0 0 0 0 0 1.5908 -5.1324 0.0000 C 0 0 0 0 0 0 0 0 0 3.0281 -5.1342 0.0000 C 0 0 0 0 0 0 0 0 0 1.5918 -4.3033 0.0000 O 0 0 0 0 0 0 0 0 0 0.8716 -5.5440 0.0000 O 0 0 0 0 0 0 0 0 0 5 7 1 1 0 0 1 2 1 0 0 0 4 8 1 1 0 0 2 3 2 0 0 0 6 9 1 0 0 0 3 4 1 0 0 0 9 10 1 0 0 0 4 5 1 0 0 0 9 11 1 0 0 0 5 6 1 0 0 0 10 12 1 0 0 0 6 1 2 0 0 0 10 13 2 0 0 0 M END