Mol:FL5FEAGL0007

<pre>

Copyright: ARM project http://www.metabolome.jp/
 35 38  0  0  0  0  0  0  0  0999 V2000
    0.0998   -4.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7324   -4.7769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9521   -4.1732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5392   -3.6812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0934   -3.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3131   -4.3963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7589   -3.0775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3459   -2.5854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2866   -2.6969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5063   -3.3006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2521   -2.9905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6994   -2.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4754   -1.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8963   -1.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5410   -1.2020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7649   -1.8173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3441   -2.3188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1198   -5.4918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7753   -1.8516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2261   -0.5012    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.8384   -1.1726    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5839   -0.9596    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3339   -1.1726    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7216   -0.5012    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.9761   -0.7142    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4990   -0.6960    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2781   -0.1911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4071   -0.6849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5843   -4.0617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1606   -1.5031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3034   -2.4929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9617   -0.7007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6795    0.0746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6410   -5.4913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1713   -6.1232    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  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
 13 14  1  0  0  0  0
 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
  1 18  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 21 19  1  0  0  0  0
 19  8  1  0  0  0  0
 23 22  1  1  0  0  0
  3 29  1  0  0  0  0
 23 30  1  0  0  0  0
 30 31  1  0  0  0  0
 15 32  1  0  0  0  0
 32 33  1  0  0  0  0
  2 34  1  0  0  0  0
 34 35  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  30  31
M  SBL   3  1  33
M  SMT   3  CH2OH
M  SVB   3 33    3.1606   -1.5031
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  34  35
M  SBL   2  1  37
M  SMT   2  OCH3
M  SVB   2 37   -3.4071   -0.3509
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  32  33
M  SBL   1  1  35
M  SMT   1  OCH3
M  SVB   1 35    1.7894     1.503
S  SKP  8
ID	FL5FEAGL0007
KNApSAcK_ID	C00005330
NAME	Betuletol 3-glucoside
CAS_RN	144599-04-2
FORMULA	C23H24O12
EXACTMASS	492.126776232
AVERAGEMASS	492.42946
SMILES	O(C)c(c1)ccc(C(O4)=C(C(=O)c(c43)c(c(OC)c(c3)O)O)O[C@H](O2)C(O)C([C@H]([C@@H](CO)2)O)O)c1
M  END

</pre>