Mol:BMFYB5DAs005
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 10 9 0 0 0 0 0 0 0 0999 V2000 2.8660 -1.7500 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 3.7321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7500 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 2.0000 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4 3 1 0 0 0 0 3 2 1 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 2 1 1 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 4 5 1 0 0 0 0 2 6 2 0 0 0 0 S SKP 7 ID BMFYB5DAs005 NAME 2-Methylene-glutaric acid FORMULA C6H8O4 EXACTMASS 144.0422 AVERAGEMASS 144.1253 SMILES OC(=O)CCC(=C)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02930 M END
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