Mol:FLIAALNS0002

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FLIAALNS0002.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 21 23  0  0  0  0  0  0  0  0999 V2000 
   -2.0044    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0044    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8918    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8918    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3355   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2208    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2208    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3355    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7769   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7769   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3717   -1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9665   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9665   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3717    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3355   -0.7694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5607    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481   -0.7694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5607   -1.1571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1827   -1.1571    0.0000 O   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 
  1 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
 14 20  1  0  0  0  0 
 12 21  1  0  0  0  0 
S  SKP  8 
ID	FLIAALNS0002 
KNApSAcK_ID	C00009453 
NAME	2'-Hydroxygenistein 
CAS_RN	1156-78-1 
FORMULA	C15H10O6 
EXACTMASS	286.047738052 
AVERAGEMASS	286.2363 
SMILES	Oc(c3)cc(O)c(c3)C(=C2)C(=O)c(c(O)1)c(O2)cc(O)c1 
M  END
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