Mol:FLIA2CGS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 34 38  0  0  0  0  0  0  0  0999 V2000
   -1.4949    0.9213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9386    0.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3823    0.9213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1738    0.6002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1738   -0.0657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7505   -0.3987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3272   -0.0657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3272    0.6002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7505    0.9332    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9384   -0.0419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3823   -0.3630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7505   -1.0642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9036   -0.3985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9036   -1.0351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4549   -1.3534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0063   -1.0351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0063   -0.3985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4549   -0.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5988    0.7175    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2526    0.2605    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.7540    0.4544    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2344    0.4486    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.6225    0.8092    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1318    0.6264    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -4.0440    0.7565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5794   -0.1698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4683   -0.0252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6118   -1.2319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9860   -0.7168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6118   -0.2017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4014    1.3534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3872    1.5211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6529    0.0501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6529   -0.7749    0.0000 C   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  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  1  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22  1  1  0  0  0  0
 16 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 17  1  0  0  0  0
 24 31  1  0  0  0  0
 31 32  1  0  0  0  0
 10 33  1  0  0  0  0
 33 34  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  31  32
M  SBL   2  1  35
M  SMT   2  CH2OH
M  SVB   2 35   -3.4014    1.3534
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  33  34
M  SBL   1  1  37
M  SMT   1  OCH3
M  SVB   1 37   -1.6529    0.0501
S  SKP  8
ID	FLIA2CGS0001
KNApSAcK_ID	C00010097
NAME	Fujikinetin 7-O-glucoside
CAS_RN	38965-67-2
FORMULA	C23H22O11
EXACTMASS	474.116211546
AVERAGEMASS	474.41418000000004
SMILES	O(C=3)c(c1)c(C(=O)C3c(c5)cc(O4)c(c5)OC4)cc(OC)c(O[C@@H]([C@@H](O)2)OC(CO)[C@@H]([C@@H]2O)O)1
M  END

</pre>