Mol:FLIAALNI0009

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Copyright: ARM project http://www.metabolome.jp/
 26 28  0  0  0  0  0  0  0  0999 V2000
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    0.2207    1.3508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9664    0.3874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  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  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 11  2  0  0  0  0
  1  2  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
 16 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
 25 26  2  0  0  0  0
S  SKP  8
ID	FLIAALNI0009
KNApSAcK_ID	C00009876
NAME	Fremontin;5,7,2',4'-Tetrahydroxy-5'-(1''',1'''-dimethylallyl)isoflavone
CAS_RN	124166-27-4
FORMULA	C20H18O6
EXACTMASS	354.110338308
AVERAGEMASS	354.35332
SMILES	C=CC(c(c1O)cc(C(C(=O)2)=COc(c3)c2c(cc(O)3)O)c(c1)O)(C)C
M  END

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