Mol:FL4DAAGM0001

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Copyright: ARM project http://www.metabolome.jp/
 33 36  0  0  0  0  0  0  0  0999 V2000
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    0.1799    0.6099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3232   -0.6275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3232    0.1974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6088   -1.7586    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1183    0.6081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434    0.1894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4949    0.1615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2464    0.1516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.2937    1.6578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  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
  9 12  1  6  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
  6 18  1  0  0  0  0
  8 19  1  1  0  0  0
 15 20  1  0  0  0  0
  2 21  1  0  0  0  0
  1 22  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  1  0  0  0
 26 25  1  1  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 23  1  0  0  0  0
 18 26  1  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 25 31  1  0  0  0  0
 32 33  1  0  0  0  0
 28 32  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  32  33
M  SBL   1  1  36
M  SMT   1 ^ CH2OH
M  SBV   1  36    0.5219   -0.4424
S  SKP  5
ID	FL4DAAGM0001
FORMULA	C22H24O11
EXACTMASS	464.13186161
AVERAGEMASS	464.41936000000004
SMILES	c(c4)(ccc(c4)C(C(O)1)Oc(c2)c(c(c(C)c2OC(C(O)3)OC(CO)C(C3O)O)O)C1=O)O
M  END

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