Mol:FL5FAAGS0007

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Copyright: ARM project http://www.metabolome.jp/
 35 38  0  0  0  0  0  0  0  0999 V2000
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    4.4060   -1.3282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  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
  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
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  1  0  0  0
 25 24  1  1  0  0  0
 25 26  1  0  0  0  0
 26 21  1  0  0  0  0
 21 27  1  0  0  0  0
 26 28  1  0  0  0  0
 25 29  1  0  0  0  0
 22 20  1  0  0  0  0
 20  8  1  0  0  0  0
 24 23  1  1  0  0  0
 15 30  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 34 35  2  0  0  0  0
 24 34  1  0  0  0  0
 31 34  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  34  35
M  SBL   1  2  37  38
M  SMT   1 CO
M  SBV   1  37   -0.7492   -0.0629
M  SBV   1  38    0.5289   -0.6398
S  SKP  5
ID	FL5FAAGS0007
FORMULA	C23H22O12
EXACTMASS	490.111126168
AVERAGEMASS	490.41358
SMILES	C(C(O)1)(C(=O)OCC)OC(OC(C(=O)3)=C(Oc(c4)c3c(cc4O)O)c(c2)ccc(c2)O)C(O)C(O)1
M  END

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