Mol:FLIAAINI0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 34 36  0  0  0  0  0  0  0  0999 V2000
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    3.4730   -0.4612    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
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  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
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 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
  2 18  1  0  0  0  0
  1 19  1  0  0  0  0
  3 20  1  0  0  0  0
 14 21  1  0  0  0  0
 18 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 16 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 13 31  1  0  0  0  0
 31 32  1  0  0  0  0
 15 33  1  0  0  0  0
 33 34  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  33
M  SMT   1 OCH3
M  SBV   1 33   -5.2110    5.0198
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  33  34
M  SBL   2  1  35
M  SMT   2 OCH3
M  SBV   2 35   -4.1988    5.5348
S  SKP  8
ID	FLIAAINI0001
KNApSAcK_ID	C00009924
NAME	Pumilaisoflavone C;5,7,4'-Trihydroxy-3',5'-dimethoxy-6,2'-diprenylisoflavone
CAS_RN	122221-90-3
FORMULA	C27H30O7
EXACTMASS	466.199153314
AVERAGEMASS	466.52290000000005
SMILES	CC(C)=CCc(c(C(C(=O)2)=COc(c3)c(c(O)c(CC=C(C)C)c3O)2)1)c(OC)c(O)c(c1)OC
M  END

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