Mol:BMAXS5CAj002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 17 16  0  0  1  0  0  0  0  0999 V2000 
    6.3301    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  2  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 
    3.7321    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    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 
    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 
    7.1962    1.5000    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    3.0000    0.0000 O   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 
    3.7320    0.5000    0.0000 O   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  6  1  1  0  0  0 
  8  7  1  0  0  0  0 
 10  9  1  0  0  0  0 
  5  4  1  0  0  0  0 
 10 17  2  0  0  0  0 
  4  3  1  0  0  0  0 
  2  3  1  0  0  0  0 
 16 10  1  0  0  0  0 
  2  1  1  0  0  0  0 
  7  6  1  0  0  0  0 
  1 11  2  0  0  0  0 
  9  8  1  0  0  0  0 
  1 12  1  0  0  0  0 
  7 15  2  0  0  0  0 
  5 13  2  0  0  0  0 
  5 14  1  0  0  0  0 
S  SKP  7 
ID	BMAXS5CAj002 
NAME	N2-Succinyl-L-glutamic acid 
FORMULA	C9H13NO7 
EXACTMASS	247.0692 
AVERAGEMASS	247.202 
SMILES	OC(=O)CC[C@H](NC(=O)CCC(O)=O)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05931 
M  END