Mol:FLNA49NS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.1438    1.0235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5875    1.3447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0314    1.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0314    0.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5454    0.0247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1221    0.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1221    1.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5454    1.3566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1436    0.3815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5875    0.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5454   -0.6408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0076   -0.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0076   -1.5985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5454   -1.9177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0983   -1.5985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0983   -0.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6984    1.3564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6984    0.0610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3094    1.9177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1272    2.8173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5010    1.6423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0009    2.5084    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
  9 18  1  0  0  0  0
  2 19  1  0  0  0  0
 19 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  21  22
M  SBL   2  1  23
M  SMT   2  OCH3
M  SVB   2 23    -1.501    1.6423
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1  OCH3
M  SVB   1 21   -0.3094    1.9177
S  SKP  8
ID	FLNA49NS0001
KNApSAcK_ID	C00010198
NAME	Kuhlmannin;6-Hydroxy-7,8-dimethoxy-4-phenylcoumarin
CAS_RN	20972-79-6
FORMULA	C17H14O5
EXACTMASS	298.084123558
AVERAGEMASS	298.29006
SMILES	COc(c(O)3)c(OC)c(O2)c(c3)C(=CC(=O)2)c(c1)cccc1
M  END

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