Mol:BMAXS2AKt007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 18 18  0  0  0  0  0  0  0  0999 V2000 
    2.8660    3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622   -2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    2.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    4.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -4.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962   -3.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  3  2  1  0  0  0  0 
  2  1  1  0  0  0  0 
  1 14  2  0  0  0  0 
  1 15  1  0  0  0  0 
  4  5  1  0  0  0  0 
  4 16  2  0  0  0  0 
  5  6  2  0  0  0  0 
  7  8  2  0  0  0  0 
  7 12  1  0  0  0  0 
 12 11  2  0  0  0  0 
 11 10  1  0  0  0  0 
 10  9  2  0  0  0  0 
  9  8  1  0  0  0  0 
  6  7  1  0  0  0  0 
 10 17  1  0  0  0  0 
  9 18  1  0  0  0  0 
 18 13  1  0  0  0  0 
  4  3  1  0  0  0  0 
S  SKP  7 
ID	BMAXS2AKt007 
NAME	N-Feruloyl-glycine 
FORMULA	C12H13NO5 
EXACTMASS	251.0793 
AVERAGEMASS	251.2353 
SMILES	COc(c1)c(O)ccc(C=CC(=O)NCC(O)=O)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02564 
M  END