Mol:LBF18107HO01

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LBF18107HO01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 24  0  0  1  0  0  0  0  0999 V2000
   -4.2823    1.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1086    1.5675    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.1571    1.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4735    1.5675    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.1028    2.3110    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4735    2.3052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8698    1.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2823    2.2819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2823    0.8531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668    1.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7793    0.8531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668    0.1386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7793   -0.5758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668   -1.2902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7793   -2.0047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668   -2.7191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9799    2.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2655    2.7191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5511    2.3066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1571    1.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 25  1  0  0  0  0
  4  3  1  4  0  0  0
  4  5  1  0  0  0  0
  2  6  1  4  0  0  0
  5  7  1  4  0  0  0
  1  8  1  0  0  0  0
  2 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
  5 15  1  0  0  0  0
 12 21  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  4 24  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  3 25  2  0  0  0  0
S  SKP  5
ID	LBF18107HO01
FORMULA	C20H38O5
EXACTMASS	358.271924326
AVERAGEMASS	358.51272
SMILES	C(CCC(O)C=CC(C(O)CCCCCCCC(O)=O)OCC)CC
M  END

</pre>

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