Mol:FLIAALNI0010

<pre>

Copyright: ARM project http://www.metabolome.jp/
 29 31  0  0  0  0  0  0  0  0999 V2000
   -2.8761    1.1282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8761    0.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3198    0.1647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7635    0.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7635    1.1282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3198    1.4494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2072    0.1647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6509    0.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6509    1.1282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2072    1.4494    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0948    0.1648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0948   -0.5220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -0.8654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0947   -0.5220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0947    0.1648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000    0.5082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2072   -0.4774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4322    1.4493    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3198   -0.4774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6889    0.5079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2712    0.1717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8523    0.5072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4322    0.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8523    1.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000    1.1943    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9607   -1.0220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8267   -1.5221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0826   -1.0369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7971   -1.4494    0.0000 C   0  0  0  0  0  0  0  0  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
  8 11  1  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 16  1  0  0  0  0
 16 11  2  0  0  0  0
  1  2  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 16 25  1  0  0  0  0
 14 26  1  0  0  0  0
 26 27  1  0  0  0  0
 13 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  28  29
M  SBL   2  1  30
M  SMT   2  OCH3
M  SVB   2 30    0.0826   -1.0369
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  26  27
M  SBL   1  1  28
M  SMT   1  OCH3
M  SVB   1 28    1.3317   -0.7282
S  SKP  8
ID	FLIAALNI0010
KNApSAcK_ID	C00009881
NAME	2'-Hydroxypiscerythrinetin;5,7,2'-Trihydroxy-4',5'-dimethoxy-3'-prenylisoflavone
CAS_RN	126484-17-1
FORMULA	C22H22O7
EXACTMASS	398.136553058
AVERAGEMASS	398.40588
SMILES	c(O2)(c1C(C(c(c3O)cc(c(OC)c3CC=C(C)C)OC)=C2)=O)cc(O)cc1O
M  END

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