Mol:BMFYS8DAp001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 14 13 0 0 0 0 0 0 0 0999 V2000 5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2500 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 3.7321 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 4 5 1 0 0 0 0 5 12 2 0 0 0 0 2 3 1 0 0 0 0 5 6 1 0 0 0 0 1 10 1 0 0 0 0 6 7 2 0 0 0 0 3 11 2 0 0 0 0 7 8 1 0 0 0 0 2 1 1 0 0 0 0 8 13 2 0 0 0 0 3 4 1 0 0 0 0 8 14 1 0 0 0 0 S SKP 7 ID BMFYS8DAp001 NAME 4-Fumaryl-acetoacetic acid FORMULA C8H8O6 EXACTMASS 200.032 AVERAGEMASS 200.1455 SMILES OC(=O)C=CC(=O)CC(=O)CC(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01061 M END
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