Mol:BMFYS7DAq002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 12 11  0  0  0  0  0  0  0  0999 V2000 
    2.8660   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  4  3  1  0  0  0  0 
  7  8  2  0  0  0  0 
  4  5  2  0  0  0  0 
  7  9  1  0  0  0  0 
  2  1  1  0  0  0  0 
  5  6  1  0  0  0  0 
  2 10  1  0  0  0  0 
  6  7  1  0  0  0  0 
  1 11  2  0  0  0  0 
  3  2  2  0  0  0  0 
  1 12  1  0  0  0  0 
S  SKP  7 
ID	BMFYS7DAq002 
NAME	2-Hydroxyhepta-2,4-dienedioic acid 
CAS_RN	53795-97-4 
FORMULA	C7H8O5 
EXACTMASS	172.0371 
AVERAGEMASS	172.1354 
SMILES	OC(=O)CC=CC=C(O)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05600 
M  END