Mol:FL2FCDGS0001

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Copyright: ARM project http://www.metabolome.jp/
 42 46  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  4  1  0  0  0  0
  7 11  2  0  0  0  0
  2 12  1  0  0  0  0
  6 13  1  0  0  0  0
  9 14  1  6  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
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 21 22  1  1  0  0  0
 22 23  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 21  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 13  1  0  0  0  0
 30 31  1  1  0  0  0
 31 32  1  1  0  0  0
 33 32  1  1  0  0  0
 33 34  1  0  0  0  0
 34 30  1  0  0  0  0
 31 35  1  0  0  0  0
 32 36  1  0  0  0  0
 30 20  1  0  0  0  0
 37 38  1  0  0  0  0
 18 37  1  0  0  0  0
 39 40  1  0  0  0  0
 32 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  OCH3
M  SBV   1  42    0.0000   -0.8079
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  39  40
M  SBL   2  1  44
M  SMT   2  CH2OH
M  SBV   2  44   -0.0307    0.6829
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    0.4915   -0.5597
S  SKP  5
ID	FL2FCDGS0001
FORMULA	C27H32O15
EXACTMASS	596.174120354
AVERAGEMASS	596.5339799999999
SMILES	c(c4)(OC(C(O)5)OCC(CO)5O)c(cc(c4)C(C1)Oc(c2)c(c(O)cc(OC(C(O)3)OC(CO)C(O)C3O)2)C(=O)1)OC
M  END

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