Mol:BMAAS4CAn002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  9  8  0  0  0  0  0  0  0  0999 V2000 
    2.8660   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.2500    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 
    3.7321    1.2500    0.0000 C   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 
    2.8660    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  4  7  2  0  0  0  0 
  4  3  1  0  0  0  0 
  2  1  1  0  0  0  0 
  6  4  1  0  0  0  0 
  1  8  1  0  0  0  0 
  3  2  1  0  0  0  0 
  1  9  2  0  0  0  0 
  2  5  2  0  0  0  0 
S  SKP  7 
ID	BMAAS4CAn002 
NAME	2-Iminobutanedioic acid 
CAS_RN	 79067-61-1 
FORMULA	C4H5NO4 
EXACTMASS	131.0218 
AVERAGEMASS	131.0868 
SMILES	N=C(CC(O)=O)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05840 
M  END