Mol:FL5FADGS0005

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FL5FADGS0005.png

 
 
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 35 38  0  0  0  0  0  0  0  0999 V2000 
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  1  2  1  0  0  0  0 
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  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
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 17 12  1  0  0  0  0 
  1 18  1  0  0  0  0 
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 16 31  1  0  0  0  0 
 33 34  2  0  0  0  0 
 33 35  1  0  0  0  0 
 23 33  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  31  32 
M  SBL   1  1  35 
M  SMT   1  OCH3 
M  SBV   1  35    0.0000   -0.7929 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  3  33  34  35 
M  SBL   2  1  38 
M  SMT   2  COOH 
M  SBV   2  38   -0.8873    0.5438 
S  SKP  5 
ID	FL5FADGS0005 
FORMULA	C22H20O13 
EXACTMASS	492.090390726 
AVERAGEMASS	492.3864 
SMILES	c(C(=O)2)(c1O)c(OC(c(c4)cc(OC)c(O)c4)=C2OC(C(O)3)OC(C(O)C3O)C(O)=O)cc(c1)O 
M  END
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