Mol:FL2FFCNS0003

Revision as of 09:00, 7 October 2008

<pre>

Copyright: ARM project http://www.metabolome.jp/
 23 25  0  0  0  0  0  0  0  0999 V2000
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   -0.2800    0.1313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7613    0.1310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2800   -1.5956    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8300    0.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2957    1.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7613    0.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3635    1.0560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0615    0.6940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6418    1.6017    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  1  1  0  0  0  0
  3  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  4  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 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 17  2  0  0  0  0
 17 11  1  0  0  0  0
  6 18  1  0  0  0  0
  2 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
  5 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  22  23
M  SBL   1  1  24
M  SMT   1  OCH3
M  SVB   1 24   -1.0615     0.694
S  SKP  8
ID	FL2FFCNS0003
KNApSAcK_ID	C00008447
NAME	8-Methoxyeriodictyol
CAS_RN	120216-93-5
FORMULA	C16H14O7
EXACTMASS	318.073952802
AVERAGEMASS	318.27816
SMILES	COc(c(O)3)c(O1)c(c(O)c3)C(=O)CC1c(c2)cc(O)c(O)c2
M  END

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