Mol:BMCCID--o011

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 13 14  0  0  0  0  0  0  0  0999 V2000 
    3.5962    1.7685    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0084    0.9595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5962    0.1505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4133   -0.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.2793    0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.2793    1.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4133    1.9595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5472    1.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5472    0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2872   -0.8006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3090   -1.0085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1453   -0.0405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.9595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  7  8  2  0  0  0  0 
  9  4  2  0  0  0  0 
  9  8  1  0  0  0  0 
  8  1  1  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  9  3  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5 12  1  0  0  0  0 
  3 10  1  0  0  0  0 
  5  6  2  0  0  0  0 
 10 11  1  0  0  0  0 
  6  7  1  0  0  0  0 
 11 13  2  0  0  0  0 
S  SKP  7 
ID	BMCCID--o011 
NAME	5-Hydroxy-indole-acetaldehyde 
FORMULA	C10H9NO2 
EXACTMASS	175.0633 
AVERAGEMASS	175.184 
SMILES	O=CCc(c1)c(c2)c(ccc(O)2)n1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05634 
M  END