Mol:FL64A9NP0003

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FL64A9NP0003.png

 
 
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 26 29  0  0  0  0  0  0  0  0999 V2000 
    1.3486    0.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6380    0.8314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0726    0.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0726   -0.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6380   -0.8096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3486   -0.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7832    0.8314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4938    0.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -0.7832   -0.8096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1304    0.7888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0592   -0.8096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7698   -0.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7698    0.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0592    0.8314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3921    0.7804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5218   -0.0130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1304    1.5920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8261    1.9937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5218    1.5920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5218    0.7888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8261    0.3871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6380   -1.5812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3525   -1.9937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7997   -1.5777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5141   -1.9902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
  3  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  4  1  0  0  0  0 
  5 23  1  0  0  0  0 
  8 11  1  1  0  0  0 
 10 25  1  0  0  0  0 
  6 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15  1  1  0  0  0  0 
 14 16  1  0  0  0  0 
 14 17  1  0  0  0  0 
 11 18  2  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  2  0  0  0  0 
 22 11  1  0  0  0  0 
 23 24  1  0  0  0  0 
 25 26  1  0  0  0  0 
S  SKP  8 
ID	FL64A9NP0003 
KNApSAcK_ID	C00013267 
NAME	Xuulanin;2H,(6R,8S)-rel-7,8-Dihydro-5,6-dimethoxy-2,2-dimethyl-8-phenyl-6H-benzo[1,2-b:5,4-b']dipyran 
CAS_RN	299410-78-9 
FORMULA	C22H24O4 
EXACTMASS	352.167459256 
AVERAGEMASS	352.42356 
SMILES	c(c4)(cccc4)C(O1)CC(c(c2OC)c1cc(O3)c(C=CC3(C)C)2)OC 
M  END
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