Mol:FLIAE8NS0002

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Copyright: ARM project http://www.metabolome.jp/
 24 27  0  0  0  0  0  0  0  0999 V2000
   -1.4912    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4912    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9349   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3786    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3786    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9349    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1777   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7340    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7340    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1777    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2901   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2901   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8849   -1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4797   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4797   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8849    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1777   -0.7694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1021    1.0347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4797    0.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1021   -0.0046    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5756   -0.7446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2901   -1.1571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3713   -0.2879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6568   -0.7004    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
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  2  1  0  0  0  0
 12 21  1  0  0  0  0
 21 22  1  0  0  0  0
  3 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  24
M  SMT   1 ^OCH3
M  SBV   1 24   -6.1203    3.3188
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  26
M  SMT   2 OCH3
M  SBV   2 26   -5.8422    3.0888
S  SKP  8
ID	FLIAE8NS0002
KNApSAcK_ID	C00009467
NAME	Tlatlancuayin;5,2-Dimethoxy-6,7-methylenedioxyisoflavone
CAS_RN	3743-44-0
FORMULA	C18H14O6
EXACTMASS	326.07903818
AVERAGEMASS	326.30016
SMILES	c(c34)c(c1c(c3OCO4)OC)OC=C(c(c2)c(OC)ccc2)C1=O
M  END

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