Mol:FL1D1AGS0001

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FL1D1AGS0001.png

 
 
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 30 32  0  0  0  0  0  0  0  0999 V2000 
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   -3.3730    0.3084    0.0000 O   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 
  4  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
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  8 17  2  0  0  0  0 
  1 18  1  0  0  0  0 
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 20 26  1  0  0  0  0 
 21 27  1  0  0  0  0 
  7 22  1  0  0  0  0 
 14 28  1  0  0  0  0 
 24 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  29  30 
M  SBL   1  1  31 
M  SMT   1  CH2OH 
M  SVB   1 31   -2.3872    0.1407 
S  SKP  8 
ID	FL1D1AGS0001 
KNApSAcK_ID	C00007988 
NAME	Davidioside 
CAS_RN	23140-78-5 
FORMULA	C21H24O9 
EXACTMASS	420.14203236599997 
AVERAGEMASS	420.40986 
SMILES	Oc(c3)ccc(c3)CCC(c(c2)c(cc(O)c2)O[C@H](O1)[C@@H](O)[C@@H](O)[C@@H](O)C1CO)=O 
M  END
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