Mol:FLNA29NS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 21 23  0  0  0  0  0  0  0  0999 V2000
   -0.4814   -0.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6477   -1.1329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2679   -1.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7388   -0.8282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3821   -1.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5544   -1.6438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0835   -2.1148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4403   -1.9424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9355   -0.0586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5557   -0.2248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8527   -0.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6874    0.0867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1389    0.5382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7556    0.3729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9209   -0.2438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4694   -0.6952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2558   -2.7575    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2087   -0.6974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1746   -0.9563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2975    0.2758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1193    0.2037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  5 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
  9 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  20  21
M  SBL   2  1  22
M  SMT   2  OCH3
M  SVB   2 22   -1.7782    0.6113
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  18  19
M  SBL   1  1  20
M  SMT   1  OCH3
M  SVB   1 20   -1.4212      1.78
S  SKP  8
ID	FLNA29NS0002
KNApSAcK_ID	C00010193
NAME	Methyldalbergin;6,7-Dimethoxy-4-phenylcoumarin
CAS_RN	1857-05-2
FORMULA	C17H14O4
EXACTMASS	282.089208936
AVERAGEMASS	282.29066
SMILES	COc(c3)c(OC)cc(c23)C(=CC(=O)O2)c(c1)cccc1
M  END

</pre>