Mol:FL1DG9NS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 26  0  0  0  0  0  0  0  0999 V2000
   -1.6200   -1.5169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8388   -0.9158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4688   -0.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8800   -1.2947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6612   -1.8959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0312   -2.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5096   -1.1837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9197   -1.6724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5467   -1.5619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9550   -2.0485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5673   -1.9406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9669   -2.4168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7543   -3.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1420   -3.1089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7424   -2.6326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7278   -0.5842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0727   -1.9761    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3067   -2.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0957   -2.6395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1970   -3.6343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1190   -0.8831    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3040   -2.6619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9467   -3.4280    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
  4  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 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
  2 22  1  0  0  0  0
 22 23  1  0  0  0  0
  5 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  24  25
M  SBL   4  1  25
M  SMT   4  OCH3
M  SVB   4 25   -0.1773    0.6731
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  22  23
M  SBL   3  1  23
M  SMT   3  OCH3
M  SVB   3 23   -2.5535   -0.1935
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  20  21
M  SBL   2  1  21
M  SMT   2  OCH3
M  SVB   2 21   -1.0081    1.2456
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  18  19
M  SBL   1  1  19
M  SMT   1  OCH3
M  SVB   1 19   -2.1962    0.9721
S  SKP  8
ID	FL1DG9NS0002
KNApSAcK_ID	C00007946
NAME	Dihydrokanakugiol
CAS_RN	117842-21-4
FORMULA	C19H22O6
EXACTMASS	346.141638436
AVERAGEMASS	346.37438
SMILES	C(c(c2O)c(c(c(c2OC)OC)OC)OC)(=O)CCc(c1)cccc1
M  END

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