Mol:FL2FADGS0001

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Copyright: ARM project http://www.metabolome.jp/
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  8  9  1  0  0  0  0
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  2 12  1  0  0  0  0
  6 13  1  0  0  0  0
  9 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 18  1  0  0  0  0
 18 19  2  0  0  0  0
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 22 23  1  1  0  0  0
 24 23  1  1  0  0  0
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 24 13  1  0  0  0  0
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 18 39  1  0  0  0  0
 41 42  1  0  0  0  0
 26 41  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  37  38
M  SBL   1  1  42
M  SMT   1  CH2OH
M  SBV   1  42   -0.0060   -0.5106
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  39  40
M  SBL   2  1  44
M  SMT   2  OCH3
M  SBV   2  44    0.0000   -0.6376
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  41  42
M  SBL   3  1  46
M  SMT   3 ^ CH2OH
M  SBV   3  46    0.7595   -0.5661
S  SKP  5
ID	FL2FADGS0001
FORMULA	C27H32O15
EXACTMASS	596.174120354
AVERAGEMASS	596.5339799999999
SMILES	c(c1)c(c(cc(C(C5)Oc(c2C(=O)5)cc(OC(O3)C(OC(O4)C(O)C(O)(C4)CO)C(O)C(C(CO)3)O)cc2O)1)OC)O
M  END

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