Mol:FL2FE9NS0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.6796    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6796   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1233   -0.8468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5670   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5670    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1233    0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0107   -0.8468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5456   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5456    0.1167    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.0107    0.4379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1017    0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6687    0.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2357    0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2357    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6687    1.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1017    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0107   -1.3906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2357   -0.8467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5597   -1.0073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8452   -1.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0368    0.7355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5367    1.6016    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  2 18  1  0  0  0  0
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  21  22
M  SBL   2  1  23
M  SMT   2  OCH3
M  SVB   2 23   -2.0368    0.7355
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1  OCH3
M  SVB   1 21   -1.5597   -1.0073
S  SKP  8
ID	FL2FE9NS0004
KNApSAcK_ID	C00008150
NAME	6-Hydroxy-5,7-dimethoxyflavanone
CAS_RN	75041-40-6
FORMULA	C17H16O5
EXACTMASS	300.099773622
AVERAGEMASS	300.30593999999996
SMILES	COc(c1)c(O)c(OC)c(C(=O)3)c1OC(C3)c(c2)cccc2
M  END

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