Mol:FL4DABGS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 32 35  0  0  0  0  0  0  0  0999 V2000 
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    3.8165    1.2810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  2  3  1  0  0  0  0 
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  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
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  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
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  7 11  2  0  0  0  0 
  9 12  1  6  0  0  0 
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 21 18  1  0  0  0  0 
  2 30  1  0  0  0  0 
 31 32  1  0  0  0  0 
 15 31  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   -0.7251   -0.4186 
S  SKP  5 
ID	FL4DABGS0001 
FORMULA	C22H24O10 
EXACTMASS	448.136946988 
AVERAGEMASS	448.41996000000006 
SMILES	O(C)c(c1)ccc(C(C4O)Oc(c2)c(C4=O)c(cc2OC(C3O)OC(C(O)C3O)C)O)c1 
M  END