Mol:FLIAEANI0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 27 29  0  0  0  0  0  0  0  0999 V2000
   -2.7195    1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7195    1.1031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1632    0.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6069    1.1031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6069    1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1632    2.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506    0.7820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4943    1.1031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4943    1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506    2.0667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0618    0.7821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0618    0.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6566   -0.2481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2513    0.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2513    0.7821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6566    1.1255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506    0.1398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1632    0.1398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2758    2.0667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8455   -0.2478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4381   -0.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4381   -1.2043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9363   -1.4919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9363   -2.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4340   -1.2046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4340    1.1945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7195    0.7820    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
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 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
  2 26  1  0  0  0  0
 26 27  1  0  0  0  0
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  SBV   1 28   -7.2043    6.4362
S  SKP  8
ID	FLIAEANI0001
KNApSAcK_ID	C00009826
NAME	Isoaurmillone;5,7-Dihydroxy-6-methoxy-4'-prenyloxyisoflavone
CAS_RN	87457-87-2
FORMULA	C21H20O6
EXACTMASS	368.125988372
AVERAGEMASS	368.37989999999996
SMILES	COc(c(O)1)c(O)cc(O3)c1C(C(=C3)c(c2)ccc(OCC=C(C)C)c2)=O
M  END

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