Mol:BMFYB6CAg001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 10  0  0  0  0  0  0  0  0  1 V2000 
   20.2039   -4.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   20.8689   -5.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   20.2039   -6.8726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   18.8739   -6.8726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   18.2089   -8.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   18.8739   -9.1762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   20.8689   -8.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   20.8689   -3.4171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   18.8739   -4.5690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   20.2039   -9.1762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   18.2089  -10.3280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  3  2  2  0  0  0  0 
 10  6  1  0  0  0  0 
  2  1  1  0  0  0  0 
  5  4  2  0  0  0  0 
  1  9  1  0  0  0  0 
  6 11  2  0  0  0  0 
  4  3  1  0  0  0  0 
  3  7  1  0  0  0  0 
  6  5  1  0  0  0  0 
  1  8  2  0  0  0  0 
S  SKP  8 
AUTODRAW	false 
ID	BMFYB6CAg001 
NAME	3-Methyl-cis,cis-muconic acid 
FORMULA	C7H8O4 
EXACTMASS	156.0422 
AVERAGEMASS	156.136 
SMILES	CC(C=CC(O)=O)=CC(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04112 
M  END