Mol:BMMCBZ1Sk040
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 10 10 0 0 0 0 0 0 0 0999 V2000 2.8660 1.2500 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 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 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.2500 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 4.5981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 8 2 0 0 0 0 3 4 1 0 0 0 0 3 2 1 0 0 0 0 8 7 1 0 0 0 0 4 5 2 0 0 0 0 2 1 1 0 0 0 0 7 6 2 0 0 0 0 1 9 1 0 0 0 0 1 10 2 0 0 0 0 5 6 1 0 0 0 0 S SKP 7 ID BMMCBZ1Sk040 NAME Phenyl-acetic acid FORMULA C8H8O2 EXACTMASS 136.0524 AVERAGEMASS 136.1479 SMILES OC(=O)Cc(c1)cccc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07086 M END
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