Mol:FLIAAAGS0009

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Copyright: ARM project http://www.metabolome.jp/
 31 34  0  0  0  0  0  0  0  0999 V2000
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   -1.7181   -0.2723    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  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
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  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
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 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 20 21  1  1  0  0  0
 21 22  1  1  0  0  0
 23 22  1  1  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 11 29  1  0  0  0  0
 23 29  1  0  0  0  0
 25 30  1  0  0  0  0
 30 31  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  30  31
M  SBL   1  1  33
M  SMT   1 ^CH2OH
M  SBV   1 33   -9.7004    4.9550
S  SKP  8
ID	FLIAAAGS0009
KNApSAcK_ID	C00010162
NAME	Genistein 5-O-glucoside
CAS_RN	128508-06-5
FORMULA	C21H20O10
EXACTMASS	432.10564686
AVERAGEMASS	432.37749999999994
SMILES	C(C1Oc(c24)cc(O)cc2OC=C(C4=O)c(c3)ccc(O)c3)(O)C(O)C(O)C(O1)CO
M  END

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