Mol:BMMCBZ2Mk007
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 11 11 0 0 0 0 0 0 0 0999 V2000 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 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 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 2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 2 3 2 0 0 0 0 6 5 1 0 0 0 0 7 8 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 5 4 2 0 0 0 0 S SKP 7 ID BMMCBZ2Mk007 NAME 3-Hydroxy-phenyl-acetic acid FORMULA C8H8O3 EXACTMASS 152.0473 AVERAGEMASS 152.1473 SMILES OC(=O)Cc(c1)cc(O)cc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05593 M END
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