Mol:113a FLIC

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m (Mol:113a FLIC moved to Mol:Glabridin over redirect)
m (Mol:Glabridin moved to Mol:113a FLIC over redirect)

Revision as of 15:57, 24 August 2010

113a FLIC.png

 
  ACD/Labs11200716302D 
 
 24 27  0  0  1  0  0  0  0  0  1 V2000 
   25.9411   -8.0841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   25.9411   -9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   24.7892   -7.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   24.7892  -10.0791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   23.6375   -8.0841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   23.6375   -9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   28.2448   -9.4141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   29.3967   -7.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   28.2448   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.0930   -6.0891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   30.5486   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.5486   -4.0940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.7006   -6.0891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.7006   -3.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   32.8524   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   32.8524   -4.0940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   34.0043   -3.4290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   31.7006   -7.4191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   22.4856   -9.4221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   23.2830  -10.7201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  3  1  1  0  0  0  0 
  4  2  1  0  0  0  0 
  5  3  2  0  0  0  0 
  6  4  1  0  0  0  0 
  6  5  1  0  0  0  0 
  8  7  2  0  0  0  0 
  9  7  1  0  0  0  0 
 10  8  1  0  0  0  0 
  1  9  2  0  0  0  0 
  2 10  2  0  0  0  0 
  2  1  1  0  0  0  0 
 12 11  1  0  0  0  0 
 13 11  1  0  0  0  0 
  7 12  1  0  0  0  0 
 14 13  1  0  0  0  0 
  9 14  1  0  0  0  0 
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 17 22  1  0  0  0  0 
  6 23  1  0  0  0  0 
  6 24  1  0  0  0  0 
S  SKP  5 
ID	Glabridin 
FORMULA	C20H20O4 
EXACTMASS	324.136159128 
AVERAGEMASS	324.37039999999996 
SMILES	Oc(c4)cc(O)c(c4)C(C3)Cc(c2)c(O3)c(C=1)c(c2)OC(C)(C)C1 
M  END
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