Mol:BMCCCC--k006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 17 18  0  0  0  0  0  0  0  0999 V2000 
    2.6691    1.5879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6473    1.3800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9563    0.4290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.9344    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.2435   -0.7300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6557   -1.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.2435   -2.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0605   -2.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.9266   -2.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.9266   -1.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0605   -0.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.1945   -1.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.1945   -2.0390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.8448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3601    2.5390    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.3164    2.1232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6557   -1.5390    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 12  5  1  0  0  0  0 
 12 13  2  0  0  0  0 
 12 11  1  0  0  0  0 
  5  6  1  0  0  0  0 
  5  4  2  0  0  0  0 
 13  7  1  0  0  0  0 
 13  8  1  0  0  0  0 
 11 10  2  0  0  0  0 
  6 17  2  0  0  0  0 
  4  3  1  0  0  0  0 
  8  9  2  0  0  0  0 
  3  2  2  0  0  0  0 
  2  1  1  0  0  0  0 
  2 16  1  0  0  0  0 
  1 14  1  0  0  0  0 
  1 15  2  0  0  0  0 
  6  7  1  0  0  0  0 
 10  9  1  0  0  0  0 
S  SKP  7 
ID	BMCCCC--k006 
NAME	(E,4Z) -2-Hydroxy-4- (2-oxo-3H-inden-1-ylidene) but-2-enoic acid 
FORMULA	C13H10O4 
EXACTMASS	230.0579 
AVERAGEMASS	230.2161 
SMILES	OC(=O)C(O)=CC=C(C(=O)1)c(c2)c(ccc2)C1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C07725 
M  END