Mol:Alpha-D-Fucose.mol

 
 
 metabolomics.jp 
 11 11  0  0  0  0  0  0  0  0999 V2000 
    0.7816    0.4603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1941   -0.2541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4008   -0.0274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3972   -0.2541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8098    0.4603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0165    0.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1941   -0.0406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8098    0.8299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1941   -1.0791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6953   -0.5374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5046    1.0791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0 
  2  3  1  1 
  3  4  1  1 
  5  4  1  1 
  5  6  1  0 
  6  1  1  0 
  4  7  1  0 
  5  8  1  0 
  2  9  1  0 
  3 10  1  0 
  6 11  1  0 
S  SKP  6 
AUTODRAW	FALSE 
ID	Alpha-D-Fucose.mol 
FORMULA	C6H12O5 
EXACTMASS	164.068473494 
AVERAGEMASS	164.15648 
SMILES	CC(O1)C(O)C(O)C(O)C(O)1 
M  END