Mol:BMAXS6ANk002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 14  0  0  1  0  0  0  0  0999 V2000 
    6.3301   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -0.7500    0.0000 C   0  0  2  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 
    4.5981   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962   -0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -0.2500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    0.7500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    6.3301    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1961   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  7  1  6  0  0  0 
  2  1  1  0  0  0  0 
  1 12  2  0  0  0  0 
  2  3  1  0  0  0  0 
  4  3  1  0  0  0  0 
  5  6  1  0  0  0  0 
  4  5  1  0  0  0  0 
  6  8  1  0  0  0  0 
  1 13  1  0  0  0  0 
  9  7  1  0  0  0  0 
  9 10  1  6  0  0  0 
 11 14  1  0  0  0  0 
 11 15  2  0  0  0  0 
  9 11  1  0  0  0  0 
S  SKP  7 
ID	BMAXS6ANk002 
NAME	D-Lysopine 
FORMULA	C9H18N2O4 
EXACTMASS	218.1266 
AVERAGEMASS	218.2503 
SMILES	NCCCC[C@H](N[C@H](C)C(O)=O)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04020 
M  END