Mol:BMMCBZ2Og009
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 18 18 0 0 0 0 0 0 0 0999 V2000 6.3301 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 17 6 1 0 0 0 0 12 11 2 0 0 0 0 9 10 2 0 0 0 0 6 5 1 0 0 0 0 6 16 2 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 2 1 1 0 0 0 0 2 15 1 0 0 0 0 1 14 1 0 0 0 0 1 13 2 0 0 0 0 11 10 1 0 0 0 0 S SKP 7 ID BMMCBZ2Og009 NAME 2-Hydroxy-6-oxo-6-(2-hydroxyphenoxy)-hexa-2,4-dienoic acid FORMULA C12H10O6 EXACTMASS 250.0477 AVERAGEMASS 250.2042 SMILES OC(=O)C(O)=CC=CC(=O)Oc(c1)c(O)ccc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07734 M END
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