Mol:FLIC1LNP0007

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FLIC1LNP0007.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 26 29  0  0  0  0  0  0  0  0999 V2000
   -1.7472    0.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7472   -0.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4780    0.4432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0783    0.7644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0341   -0.5202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0341   -1.2070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6289   -1.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2237   -1.2070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2237   -0.5202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6289   -0.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3033    0.7643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4399   -1.5501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1909    1.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7472    1.7279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3033    1.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3033    2.1345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8769    1.0756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8769   -1.4193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2116   -1.7220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9260   -2.1345    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  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
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
 12 18  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 17  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 14 24  1  0  0  0  0
 13 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  25  26
M  SBL   1  1  28
M  SMT   1 OCH3
M  SBV   1 28   -6.0998    3.9429
S  SKP  8
ID	FLIC1LNP0007
KNApSAcK_ID	C00009730
NAME	3'-Methoxyglabridin
CAS_RN	74046-05-2
FORMULA	C21H22O5
EXACTMASS	354.146723814
AVERAGEMASS	354.39638
SMILES	COc(c1O)c(ccc1C(C4)Cc(c3)c(O4)c(c(c3)2)C=CC(C)(C)O2)O
M  END

</pre>

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