Mol:FL1DECNF0001

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FL1DECNF0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 27 30  0  0  0  0  0  0  0  0999 V2000
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    2.8014    0.5261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3515    1.2456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9160    2.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2083    0.8534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6578    1.3533    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
  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 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
  1 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20  2  1  0  0  0  0
 12 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 13  1  0  0  0  0
  6 24  1  0  0  0  0
 24 25  1  0  0  0  0
  5 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  26  27
M  SBL   2  1  29
M  SMT   2  OCH3
M  SVB   2 29   -0.5206    0.6731
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  24  25
M  SBL   1  1  27
M  SMT   1  OCH3
M  SVB   1 27   -1.3515    1.2456
S  SKP  8
ID	FL1DECNF0001
KNApSAcK_ID	C00007962
NAME	2'-Hydroxy-5',6'-dimethoxy-3,4-methylenedioxyfurano[2'',3'':4',3'] dihydrochalcon
CAS_RN	77985-80-9
FORMULA	C20H18O7
EXACTMASS	370.10525293
AVERAGEMASS	370.35272
SMILES	c(c34)cc(cc3OCO4)CCC(=O)c(c1O)c(c(c(o2)c(cc2)1)OC)OC
M  END

</pre>

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