Mol:FL5FA9GL0001

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FL5FA9GL0001.png

 
 
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 31 34  0  0  0  0  0  0  0  0999 V2000 
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   -0.6646    0.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    0.7238   -1.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4693   -0.8907    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2192   -1.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6070   -0.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8615   -0.6453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3915   -0.6252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1684   -0.1137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1663   -0.7553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4459    0.5075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3335   -1.4192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7314   -1.0770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4459   -1.4895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
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 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
 19 20  1  0  0  0  0 
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 21 22  1  1  0  0  0 
 23 22  1  1  0  0  0 
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 24 19  1  0  0  0  0 
 19 25  1  0  0  0  0 
 24 26  1  0  0  0  0 
 23 27  1  0  0  0  0 
 20 18  1  0  0  0  0 
 18  8  1  0  0  0  0 
  1 28  1  0  0  0  0 
  3 29  1  0  0  0  0 
 22 30  1  0  0  0  0 
 30 31  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  30  31 
M  SBL   1  1  33 
M  SMT   1 CH2OH 
M  SBV   1 33   -4.8072    7.5556 
S  SKP  8 
ID	FL5FA9GL0001 
KNApSAcK_ID	C00005120 
NAME	Galanginin 
CAS_RN	68592-14-3 
FORMULA	C21H20O10 
EXACTMASS	432.10564686 
AVERAGEMASS	432.37749999999994 
SMILES	O(C(C(=O)3)=C(Oc(c4)c3c(cc(O)4)O)c(c2)cccc2)C(C(O)1)OC(CO)C(O)C1O 
M  END
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