KEGG:C00804 Propynoate ISISHOST03240423032D 1 1.00000 0.00000 763 5 4 0 0 0 999 V2000 0.2586 0.1483 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3897 -0.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0.9103 -0.2241 0.0000 O 0 0 0 0 0 0 0 0 0 0.2586 0.9000 0.0000 O 0 0 0 0 0 0 0 0 0 -1.0379 -0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 2 5 3 0 0 0 M END