Mol:FLIA19NM0002

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Copyright: ARM project http://www.metabolome.jp/
 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.8068    0.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8068    0.0451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2505   -0.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6942    0.0451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6942    0.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2505    1.0086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1379   -0.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4184    0.0451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4184    0.6874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1379    1.0086    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9745   -0.2760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9745   -0.9628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693   -1.3062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1641   -0.9628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1641   -0.2760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5693    0.0674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1379   -0.9182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9745    1.0085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1641    1.3062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6641    2.1722    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
  8 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
  9 18  1  0  0  0  0
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
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   -2.1641    1.3062
S  SKP  8
ID	FLIA19NM0002
KNApSAcK_ID	C00009381
NAME	7-Methoxy-2-methylisoflavone
CAS_RN	19725-44-1
FORMULA	C17H14O3
EXACTMASS	266.09429431399997
AVERAGEMASS	266.29125999999997
SMILES	COc(c3)cc(O1)c(c3)C(=O)C(c(c2)cccc2)=C(C)1
M  END

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