Mol:LBF20406LT09

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 25  0  0  0  0  0  0  0  0999 V2000 
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    4.5981   -4.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    4.5981   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    3.7321   -6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    8.9282    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   10.6603    6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5263    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -6.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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   12.3923    6.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  6 23  1  0  0  0  0 
  6 24  2  0  0  0  0 
 20 25  1  0  0  0  0 
 20 26  2  0  0  0  0 
S  SKP  5 
ID	LBF20406LT09 
FORMULA	C20H30O6 
EXACTMASS	366.204238692 
AVERAGEMASS	366.4486 
SMILES	C(CCCC(O)=O)C=CC[C@H](C=CC=CC=C[C@H](CCCC(O)=O)O)O 
M  END