Mol:FLICUNNS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 29  0  0  0  0  0  0  0  0999 V2000
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   -2.0196    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4633   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9070    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9070    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2056    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3507    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7617   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7617   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3565   -1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9512   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9512   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3565    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6306    1.0347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0081    0.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6044   -1.0262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0081   -0.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6044    0.0850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3507   -0.7694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7617   -1.1571    0.0000 C   0  0  0  0  0  0  0  0  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  1  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
  1 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  2  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 15  1  0  0  0  0
  7 23  1  0  0  0  0
 12 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  24  25
M  SBL   1  1  28
M  SMT   1 ^OCH3
M  SBV   1 28   -5.9269    2.7619
S  SKP  8
ID	FLICUNNS0001
KNApSAcK_ID	C00009740
NAME	Ambanol
CAS_RN	63838-66-4
FORMULA	C19H16O6
EXACTMASS	340.094688244
AVERAGEMASS	340.32674
SMILES	c(c45)c(c(OC)cc4OCO5)C(C3O)COc(c32)cc(c1c2)occ1
M  END

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