Mol:LBF18207PG01

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LBF18207PG01.png

 
 
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 24 24  0  0  0  0  0  0  0  0999 V2000 
    2.5878    0.4660    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    2.2788   -0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    3.5878    0.4660    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
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    5.0558   -1.7722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.0068   -2.0812    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
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    7.1658   -3.3684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    8.3248   -4.6556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.5327   -5.6337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0878   -2.0728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7743    2.2931    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.7500   -1.4121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5322    4.6156    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1309    5.6337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
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  1 19  1  6  0  0  0 
  3 20  1  6  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
  7 21  2  0  0  0  0 
  4 11  1  1  0  0  0 
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 17 18  1  0  0  0  0 
 13 22  1  6  0  0  0 
 10 23  1  0  0  0  0 
 10 24  2  0  0  0  0 
S  SKP  5 
ID	LBF18207PG01 
FORMULA	C18H30O6 
EXACTMASS	342.204238692 
AVERAGEMASS	342.42719999999997 
SMILES	[C@@H]([C@@H](CC(=O)CCC(O)=O)1)(C=C[C@H](O)CCCCC)[C@H](O)C[C@@H]1O 
M  END
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