Mol:FL3FF9NS0007

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Copyright: ARM project http://www.metabolome.jp/
 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.7790    0.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7790   -0.4910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2227   -0.8121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6664   -0.4910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6664    0.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2227    0.4726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1101   -0.8121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4462   -0.4910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4462    0.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1101    0.4726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1101   -1.3130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0023    0.4725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1362    0.4725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1362    1.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693    1.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0023    1.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2227   -1.4545    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2227    1.1147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1362    0.7702    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6361    1.6363    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
 18  3  1  0  0  0  0
  6 19  1  0  0  0  0
  1 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  20  21
M  SBL   1  1  22
M  SMT   1  OCH3
M  SVB   1 22   -2.1362    0.7702
S  SKP  8
ID	FL3FF9NS0007
KNApSAcK_ID	C00004070
NAME	5,8-Dihydroxy-7-methoxyflavone
CAS_RN	4431-47-4
FORMULA	C16H12O5
EXACTMASS	284.068473494
AVERAGEMASS	284.26348
SMILES	COc(c3)c(O)c(O1)c(c(O)3)C(=O)C=C(c(c2)cccc2)1
M  END

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