Mol:BMAXS2AKt005

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 13 13  0  0  0  0  0  0  0  0999 V2000 
    2.8660    2.0000    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 
    3.7321    0.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    0.0000    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 
    3.7321   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -3.0000    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 
    5.4641   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 10  5  2  0  0  0  0 
 10  9  1  0  0  0  0 
  9  8  2  0  0  0  0 
  8  7  1  0  0  0  0 
  7  6  2  0  0  0  0 
  6  5  1  0  0  0  0 
  4  3  1  0  0  0  0 
  4 13  2  0  0  0  0 
  5  4  1  0  0  0  0 
  3  2  1  0  0  0  0 
  1 11  1  0  0  0  0 
  1 12  2  0  0  0  0 
  2  1  1  0  0  0  0 
S  SKP  7 
ID	BMAXS2AKt005 
NAME	N-Benzoyl-glycine 
FORMULA	C9H9NO3 
EXACTMASS	179.0582 
AVERAGEMASS	179.1727 
SMILES	OC(=O)CNC(=O)c(c1)cccc1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01586 
M  END