Mol:FLNAFCNS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
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   -0.6862    1.6292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1301    0.6421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4466    0.3092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0234    0.6421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0234    1.3081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4466   -0.3563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9996   -1.3140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4466   -2.2713    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5521   -1.6330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5997    1.9267    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0997    2.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1630    0.2077    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4485   -0.2048    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
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  5 11  1  0  0  0  0
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 15 16  2  0  0  0  0
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  7 17  2  0  0  0  0
  2 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 10 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  25
M  SMT   2  OCH3
M  SVB   2 25    -1.163    0.2077
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  23
M  SMT   1  OCH3
M  SVB   1 23   -1.5997    1.9267
S  SKP  8
ID	FLNAFCNS0002
KNApSAcK_ID	C00010231
NAME	8,3',4'-Trihydroxy-5,7-dimethoxy-4-phenylcoumarin
CAS_RN	123297-24-5
FORMULA	C17H14O7
EXACTMASS	330.073952802
AVERAGEMASS	330.28886
SMILES	COc(c3)c(O)c(O2)c(c(OC)3)C(=CC(=O)2)c(c1)cc(O)c(O)c1
M  END

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