Mol:BMMCBZ4Sk006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 15  0  0  0  0  0  0  0  0999 V2000 
    4.5981   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  5  4  2  0  0  0  0 
  5 15  1  0  0  0  0 
  4  3  1  0  0  0  0 
  3 12  1  0  0  0  0 
  3  2  2  0  0  0  0 
 12 13  1  0  0  0  0 
  2  1  1  0  0  0  0 
  1  7  1  0  0  0  0 
  1  6  2  0  0  0  0 
  7  8  2  0  0  0  0 
  6  5  1  0  0  0  0 
  8  9  1  0  0  0  0 
  4 14  1  0  0  0  0 
  9 10  1  0  0  0  0 
  9 11  2  0  0  0  0 
S  SKP  7 
ID	BMMCBZ4Sk006 
NAME	5-Hydroxy-ferulic acid 
FORMULA	C10H10O5 
EXACTMASS	210.0528 
AVERAGEMASS	210.1834 
SMILES	COc(c1)c(O)c(O)cc(C=CC(O)=O)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05619 
M  END