Mol:BMACBZHOg011

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 18 18  0  0  1  0  0  0  0  0999 V2000 
    5.4641   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -2.2500    0.0000 C   0  0  0  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 
    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  1  0  0  0  0  0  0  0  0  0 
    4.5981    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    0.2500    0.0000 N   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 
    2.8660    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    3.7500    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 
    3.7321    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -3.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  8  7  1  0  0  0  0 
 16  9  2  0  0  0  0 
  9  8  1  0  0  0  0 
  8 10  1  6  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  7  1  1  0  0  0  0 
  4 17  1  0  0  0  0 
  9 15  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 11 18  2  0  0  0  0 
 15 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
S  SKP  7 
ID	BMACBZHOg011 
NAME	N-Acetyl-L-tyrosine ethyl ester 
FORMULA	C13H17NO4 
EXACTMASS	251.1157 
AVERAGEMASS	251.2784 
SMILES	CCOC(=O)[C@@H](NC(C)=O)Cc(c1)ccc(O)c1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01657 
M  END