Mol:LBST03010027

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LBST03010027.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 29 33  0  0  0  0  0  0  0  0999 V2000 
    4.6950    2.9661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5140    4.6886    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
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    7.4975    5.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    3.6473   -5.7067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9781   -4.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2872   -4.0125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    2.0000   -5.1715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.2216   -3.3887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6180   -3.2693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6005    5.0954    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 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  1  6  1  0  0  0  0 
  5  7  1  0  0  0  0 
  8  7  1  1  0  0  0 
 10  9  1  0  0  0  0 
 10  6  1  1  0  0  0 
  9 11  1  4  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  6  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
  9 15  1  0  0  0  0 
 11 16  1  1  0  0  0 
 16 17  1  0  0  0  0 
 18 17  1  1  0  0  0 
 12 18  1  0  0  0  0 
  8 10  1  0  0  0  0 
 12 19  1  1  0  0  0 
 20 21  2  0  0  0  0 
 21 22  1  0  0  0  0 
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 18 22  1  0  0  0  0 
 22 27  1  6  0  0  0 
 25 28  1  1  0  0  0 
  2 29  1  1  0  0  0 
  8  9  1  0  0  0  0 
S  SKP  5 
ID	LBST03010027 
FORMULA	C28H44O 
EXACTMASS	396.33921603 
AVERAGEMASS	396.64835999999997 
SMILES	C(C2)(=C([C@H](C([C@@H]45)3CCC[C@]4(C)[C@@H]([C@@H](C=C[C@@H](C(C)C)C)C)CC5)[C@@H]23)1)CC[C@H](O)C1 
M  END
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