Mol:BMMCPD--k007
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 13 13 0 0 0 0 0 0 0 0999 V2000 4.5981 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5 4 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 2 8 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 3 9 1 0 0 0 0 4 12 1 0 0 0 0 12 13 1 0 0 0 0 1 7 1 0 0 0 0 S SKP 7 ID BMMCPD--k007 NAME 3-Carboxy-4-methoxy-N-methyl-2-pyridone FORMULA C8H9NO4 EXACTMASS 183.0531 AVERAGEMASS 183.1614 SMILES COC(C=1)=C(C(O)=O)C(=O)N(C)C1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04447 M END
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