KEGG:C02512 3-Cyano-L-alanine ISISHOST03240423062D 1 1.00000 0.00000 2248 8 7 0 1 0 999 V2000 0.1448 -0.0655 0.0000 C 0 0 1 0 0 0 0 0 0 -0.4931 0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 0.8621 0.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0.1379 -0.8034 0.0000 N 0 0 0 0 0 0 0 0 0 -1.1621 0.0069 0.0000 C 0 0 0 0 0 0 0 0 0 1.4759 -0.2552 0.0000 O 0 0 0 0 0 0 0 0 0 0.8621 0.9276 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8310 -0.3345 0.0000 N 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 1 0 0 2 5 1 0 0 0 3 6 1 0 0 0 3 7 2 0 0 0 5 8 3 0 0 0 M END