Mol:BMFYB5DAk003

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BMFYB5DAk003.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 13 12  0  0  0  0  0  0  0  0  1 V2000
   21.2085   -5.4154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0566   -6.0804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0566   -7.4104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2085   -8.0754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2085   -4.0854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9049   -8.0754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9049   -5.4154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0566   -3.4204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3603   -3.4204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7530   -7.4104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9049   -9.4054    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9049   -4.0854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7530   -6.0804    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
  1  5  1  0  0  0  0
  2  3  2  0  0  0  0
  6 10  1  0  0  0  0
  6 11  2  0  0  0  0
  3  6  1  0  0  0  0
  3  4  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  2  0  0  0  0
  2  7  1  0  0  0  0
S  SKP  7
ID	BMFYB5DAk003
NAME	(Z)-But-2-ene-1,2,3-tricarboxylic acid
FORMULA	C7H8O6
EXACTMASS	188.032
AVERAGEMASS	188.1348
SMILES	OC(=O)CC(C(O)=O)=C(C)C(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04225
M  END

</pre>

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