Mol:BMMCPD--k025
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 9 9 0 0 0 0 0 0 0 0999 V2000 3.7321 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6 5 2 0 0 0 0 5 4 1 0 0 0 0 4 3 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 S SKP 7 ID BMMCPD--k025 NAME Picolinic acid FORMULA C6H5NO2 EXACTMASS 123.032 AVERAGEMASS 123.1094 SMILES OC(=O)c(c1)nccc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C10164 M END