Mol:D-Fucose.mol

 
 
 metabolomics.jp 
 15 14  0  0  0  0  0  0  0  0999 V2000 
    0.0000    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8250   -0.6188    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8250   -0.6188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8250   -1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8250   -1.4438    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -2.2688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8250    0.2062    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8250    0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000    1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8250    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8250    1.0312    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000    1.8562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145    2.2688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0 
  2  3  1  0 
  2  4  1  0 
  2  5  1  0 
  5  6  1  0 
  5  7  1  0 
  5  8  1  0 
  1  9  1  0 
  1 10  1  0 
  1 11  1  0 
 11 12  1  0 
 11 13  1  0 
 11 14  1  0 
 14 15  2  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  14  15 
M  SBL   1  1  13 
M  SMT   1 CHO 
M  SBV   1  13    0.0000   -0.8250 
S  SKP  6 
AUTODRAW	FALSE 
ID	D-Fucose.mol 
FORMULA	C6H12O5 
EXACTMASS	164.068473494 
AVERAGEMASS	164.15648 
SMILES	O=CC([H])(O)C([H])(O)C([H])(O)C([H])(C)O 
M  END