Mol:FL1CDAGS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 33 35  0  0  0  0  0  0  0  0999 V2000
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   -0.3998    0.3732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0538   -1.2048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3062    0.9590    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7277    0.7937    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.5870    0.8093    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.5728    1.8774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2049   -0.6794    0.0000 O   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  2  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
 17 13  1  0  0  0  0
  3 18  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  1  0  0  0
 21 22  1  1  0  0  0
 23 22  1  1  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 25  1  0  0  0  0
 24 26  1  0  0  0  0
 23 27  1  0  0  0  0
 17 20  1  0  0  0  0
  5 28  1  0  0  0  0
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  1 30  1  0  0  0  0
 30 31  1  0  0  0  0
 22 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  32  33
M  SBL   3  1  34
M  SMT   3  CH2OH
M  SVB   3 34    3.3583    0.4647
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  30  31
M  SBL   2  1  32
M  SMT   2  OCH3
M  SVB   2 32   -4.0728    1.0114
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  28  29
M  SBL   1  1  30
M  SMT   1  OCH3
M  SVB   1 30   -2.0538    0.7123
S  SKP  8
ID	FL1CDAGS0001
KNApSAcK_ID	C00007888
NAME	4,2'-Dihydroxy-4',6'-dimethoxychalcone 4-glucoside
CAS_RN	68984-71-4
FORMULA	C23H26O10
EXACTMASS	462.152597052
AVERAGEMASS	462.44654
SMILES	c(c3)(c(c(cc3OC)O)C(=O)C=Cc(c2)ccc(c2)O[C@@H](C(O)1)O[C@H](CO)[C@H](O)C1O)OC
M  END

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