Mol:BMFYB6DAk003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 14 13 0 0 0 0 0 0 0 0999 V2000 6.3301 1.2500 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 5.4641 -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 3.7321 -0.2500 0.0000 C 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 4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2500 0.0000 O 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 3.7320 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5 4 2 0 0 0 0 4 3 1 0 0 0 0 3 2 2 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 2 1 1 0 0 0 0 5 6 1 0 0 0 0 7 13 1 0 0 0 0 7 14 2 0 0 0 0 4 7 1 0 0 0 0 2 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 2 0 0 0 0 S SKP 7 ID BMFYB6DAk003 NAME (Z) -2- (2,2-Dihydroxyethenyl) -4-oxopent-2-enedioic acid CAS_RN 82784-81-4 FORMULA C7H6O7 EXACTMASS 202.0113 AVERAGEMASS 202.1183 SMILES OC(=O)C=C(C=C(O)C(O)=O)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04451 M END