Mol:BMMCPD--k009
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 11 11 0 0 0 0 0 0 0 0999 V2000 3.7321 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 4 2 0 0 0 0 3 2 1 0 0 0 0 2 1 2 0 0 0 0 1 6 1 0 0 0 0 6 5 2 0 0 0 0 5 4 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 5 8 1 0 0 0 0 3 9 1 0 0 0 0 2 7 1 0 0 0 0 S SKP 7 ID BMMCPD--k009 NAME 3-Hydroxy-2-methyl-pyridine-5-carboxylic acid FORMULA C7H7NO3 EXACTMASS 153.0425 AVERAGEMASS 153.1354 SMILES Cc(n1)c(O)cc(c1)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01270 M END