Mol:BMMCLA--k015

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BMMCLA--k015.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 10 10  0  0  1  0  0  0  0  0999 V2000
    3.5878    1.0492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8968    0.0981    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.0878   -0.4897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2788    0.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878    1.0492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8479   -0.2109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0558   -1.1891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3126   -1.8582    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0068   -1.4981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.8582    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  5  4  1  0  0  0  0
  2  3  1  0  0  0  0
  2  1  1  4  0  0  0
  1  5  1  0  0  0  0
  4  3  2  0  0  0  0
  5 10  2  0  0  0  0
  2  6  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  6  7  1  0  0  0  0
S  SKP  7
ID	BMMCLA--k015
NAME	Mucono-lactone
FORMULA	C6H6O4
EXACTMASS	142.0266
AVERAGEMASS	142.1094
SMILES	OC(=O)CC(C=1)OC(=O)C1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04105
M  END

</pre>

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