Mol:BMMCIZ--k010

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 11  0  0  1  0  0  0  0  0999 V2000 
    2.8090   -0.1807    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3090    1.3582    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3090    1.3582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6180    0.4071    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    4.5691    0.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7770   -0.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.7281   -1.1891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8968    2.1672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.4712   -0.5199    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.9360   -2.1672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  3  2  2  0  0  0  0 
  5  1  1  4  0  0  0 
  5  4  1  0  0  0  0 
  4  3  1  0  0  0  0 
  2  1  1  0  0  0  0 
  4  9  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8 10  1  0  0  0  0 
  8 11  2  0  0  0  0 
S  SKP  7 
ID	BMMCIZ--k010 
NAME	3- (5-Oxo-1,4-dihydroimidazol-4-yl) propanoic acid 
CAS_RN	17340-16-8 
FORMULA	C6H8N2O3 
EXACTMASS	156.0534 
AVERAGEMASS	156.1394 
SMILES	OC(=O)CCC(N1)C(=O)N=C1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03680 
M  END