Mol:FL5FCAGS0003

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Copyright: ARM project http://www.metabolome.jp/
 34 37  0  0  0  0  0  0  0  0999 V2000
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    1.8484    2.0086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2462   -2.2222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4304   -1.7912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0657   -3.2461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  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
  3 18  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 21 19  1  0  0  0  0
 19  8  1  0  0  0  0
 23 22  1  1  0  0  0
 15 29  1  0  0  0  0
 30 31  1  0  0  0  0
  1 30  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 23 32  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  30  31
M  SBL   1  1  34
M  SMT   1 ^ OCH3
M  SBV   1  34    0.7147   -0.4126
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  3  32  33  34
M  SBL   2  1  37
M  SMT   2  COOH
M  SBV   2  37   -0.9127    0.6169
S  SKP  5
ID	FL5FCAGS0003
FORMULA	C22H20O12
EXACTMASS	476.095476104
AVERAGEMASS	476.387
SMILES	O(C(C(=O)4)=C(Oc(c43)cc(cc3O)OC)c(c2)ccc(c2)O)C(C(O)1)OC(C(O)C1O)C(O)=O
M  END

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