Mol:LBF20406LT02

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LBF20406LT02.png

 
 
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 24 23  0  0  0  0  0  0  0  0999 V2000 
    8.9282    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    5.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5263    7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    1.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    7.1962    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -3.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    4.5981   -4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.5282    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -6.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -7.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  9 10  1  0  0  0  0 
  1  3  2  0  0  0  0 
  2  9  1  0  0  0  0 
  9 21  1  6  0  0  0 
 11 10  2  0  0  0  0 
 11 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  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 
 16 22  1  6  0  0  0 
 20 23  1  0  0  0  0 
 20 24  2  0  0  0  0 
S  SKP  5 
ID	LBF20406LT02 
FORMULA	C20H32O4 
EXACTMASS	336.23005951199997 
AVERAGEMASS	336.46567999999996 
SMILES	C(CC=CC[C@H](C=CC=CC=C[C@H](CCCC(O)=O)O)O)CCC 
M  END
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