Mol:BMMCIZ--l001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 11  0  0  1  0  0  0  0  0999 V2000 
    3.2601   -0.4964    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9511   -1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7601   -2.0352    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5691   -1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.2601   -0.4964    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    4.8479    0.3126    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4411    1.2262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4466    1.3307    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.7564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5201   -1.7564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0289    2.0352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  5  4  1  0  0  0  0 
  3  2  1  0  0  0  0 
  2  1  1  0  0  0  0 
  1  5  1  0  0  0  0 
  4  3  1  0  0  0  0 
  5  6  1  1  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  7 11  2  0  0  0  0 
  2  9  2  0  0  0  0 
  4 10  2  0  0  0  0 
S  SKP  7 
ID	BMMCIZ--l001 
NAME	(R)(-)-Allantoin 
FORMULA	C4H6N4O3 
EXACTMASS	158.0439 
AVERAGEMASS	158.1156 
SMILES	NC(=O)N[C@H](N1)C(=O)NC(=O)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02348 
M  END