Mol:FL5FACGS0064

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 34 37  0  0  0  0  0  0  0  0999 V2000 
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    1.7913    1.8832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1760    0.4903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1609    0.6636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8337   -0.4492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
  2  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
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 32 34  1  0  0  0  0 
 26 32  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  3  32  33  34 
M  SBL   1  1  37 
M  SMT   1  COOH 
M  SBV   1  37   -0.9134    0.0678 
S  SKP  5 
ID	FL5FACGS0064 
FORMULA	C21H18O13 
EXACTMASS	478.07474066199995 
AVERAGEMASS	478.35982 
SMILES	C(C(C(O)=O)1)(O)C(C(C(Oc(c4)c(O)cc(c4)C(=C3O)Oc(c2)c(C3=O)c(cc(O)2)O)O1)O)O 
M  END