Mol:BMSUM6Nm--01

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 15  0  0  1  0  0  0  0  0999 V2000 
    4.5981    0.7500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    3.7321    0.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    3.7321   -0.7500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    4.5981   -1.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.4641   -0.7500    0.0000 C   0  0  1  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 
    4.5981    1.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 15  6  1  0  0  0  0 
  5 14  1  6  0  0  0 
 14  1  1  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  1  7  1  4  0  0  0 
  2  8  1  1  0  0  0 
  3 12  1  6  0  0  0 
  4 13  1  1  0  0  0 
  8  9  1  0  0  0  0 
  9 11  2  0  0  0  0 
  9 10  1  0  0  0  0 
S  SKP  7 
ID	BMSUM6Nm--01 
NAME	N-Acetyl-D-glucosaminyl-amine 
FORMULA	C8H16N2O5 
EXACTMASS	220.1059 
AVERAGEMASS	220.2231 
SMILES	OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)C(N)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01239 
M  END