Mol:FL5F9AGL0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 31 34  0  0  0  0  0  0  0  0999 V2000
   -3.1678    0.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1678   -0.4559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6115   -0.7771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0552   -0.4559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0552    0.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6115    0.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4989   -0.7771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9426   -0.4559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9426    0.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4989    0.5076    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4989   -1.2779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3865    0.5075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1804    0.1802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7474    0.5075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7474    1.1622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1804    1.4895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3865    1.1622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2120   -0.9237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8334   -0.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4458   -1.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1912   -0.8907    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9412   -1.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3289   -0.4323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5834   -0.6453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1134   -0.6252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8904   -0.1137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8883   -0.7553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4534   -1.0770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1678   -1.4895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3142    1.4894    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0287    1.0769    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
 19 20  1  0  0  0  0
 20 21  1  1  0  0  0
 21 22  1  1  0  0  0
 23 22  1  1  0  0  0
 23 24  1  0  0  0  0
 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
 22 28  1  0  0  0  0
 28 29  1  0  0  0  0
 15 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  28  29
M  SBL   1  1  31
M  SMT   1 CH2OH
M  SBV   1 31   -5.0853    7.5556
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  30  31
M  SBL   2  1  33
M  SMT   2 OCH3
M  SBV   2 33   -5.0307    7.8562
S  SKP  8
ID	FL5F9AGL0001
KNApSAcK_ID	C00005119
NAME	3-Hydroxy-4'-methoxyflavone 3-glucoside
CAS_RN	135557-21-0
FORMULA	C22H22O9
EXACTMASS	430.126382302
AVERAGEMASS	430.40468000000004
SMILES	O(C)c(c1)ccc(C(=C(OC(O4)C(O)C(C(C(CO)4)O)O)2)Oc(c3)c(ccc3)C2=O)c1
M  END

</pre>