Mol:FL5F9CNS0001

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Copyright: ARM project http://www.metabolome.jp/
 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.5983    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5983   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0420   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4857   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4857    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0420    0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9294   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3731   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3731    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9294    0.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9294   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1830    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    0.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3170    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3170    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1830    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1830   -0.8828    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8838    1.3836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5983    0.9711    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
  8 18  1  0  0  0  0
 15 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  SBV   1 21   -7.5961    8.3279
S  SKP  8
ID	FL5F9CNS0001
KNApSAcK_ID	C00004532
NAME	3-Hydroxy-4'-methoxyflavone
CAS_RN	6889-78-7
FORMULA	C16H12O4
EXACTMASS	268.073558872
AVERAGEMASS	268.26408
SMILES	COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(ccc2)1
M  END

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