Mol:BMMCPYXXk010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 11 11 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 2.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0000 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 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5 6 2 0 0 0 0 5 4 1 0 0 0 0 4 3 1 0 0 0 0 3 2 1 0 0 0 0 2 1 1 0 0 0 0 1 6 1 0 0 0 0 7 9 1 0 0 0 0 7 8 2 0 0 0 0 6 7 1 0 0 0 0 4 11 2 0 0 0 0 2 10 2 0 0 0 0 S SKP 7 ID BMMCPYXXk010 NAME Orotic acid FORMULA C5H4N2O4 EXACTMASS 156.0171 AVERAGEMASS 156.0963 SMILES O=C(C=1)NC(=O)NC1C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00295 M END