Mol:BMFYB6SAk003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 13 12  0  0  0  0  0  0  0  0999 V2000
    6.3301    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.2500    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    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962   -0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  2  0  0  0  0
  1  8  1  0  0  0  0
  1  9  2  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  6 10  2  0  0  0  0
  5  6  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  2  0  0  0  0
  3  7  1  0  0  0  0
  2 13  1  0  0  0  0
S  SKP  7
ID	BMFYB6SAk003
NAME	3-Carboxy-2-hydroxy-muconate semialdehyde
FORMULA	C7H6O6
EXACTMASS	186.0164
AVERAGEMASS	186.1189
SMILES	O=CC=CC(C(O)=O)=C(O)C(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04480
M  END

</pre>