Mol:FL7AAIGO0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 34 37  0  0  0  0  0  0  0  0999 V2000 
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    3.8762    0.0945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1383    2.4973    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7051    3.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
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  7  8  2  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
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 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
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 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  1 17  1  0  0  0  0 
 14 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
 20  8  1  0  0  0  0 
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 31 32  1  0  0  0  0 
 13 31  1  0  0  0  0 
 33 34  1  0  0  0  0 
 15 33  1  0  0  0  0 
M  CHG  1  10   1 
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   -0.7254    0.4188 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  33  34 
M  SBL   2  1  37 
M  SMT   2  OCH3 
M  SBV   2  37    0.0000   -0.7228 
S  SKP  5 
ID	FL7AAIGS0003 
FORMULA	C23H25O11 
EXACTMASS	477.139686642 
AVERAGEMASS	477.43800000000005 
SMILES	O(C(O4)C(C(C(O)C4C)O)O)c(c1)c(c(c3)cc(c(c(OC)3)O)OC)[o+1]c(c2)c(c(O)cc(O)2)1 
M  END