Mol:FL5FBDNS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
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   -1.9630   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2622   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2941    0.1499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2941   -1.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3853   -0.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9523    0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9523    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9523    0.8044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8431   -1.2954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286   -1.7079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6687    1.7079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    2.6052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  2  0  0  0  0
  9 10  1  0  0  0  0
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  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
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  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
 15 20  1  0  0  0  0
  3 21  1  0  0  0  0
 21 22  1  0  0  0  0
 16 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    1.6687    1.7079
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   -1.8431   -1.2954
S  SKP  8
ID	FL5FBDNS0001
KNApSAcK_ID	C00004641
NAME	Quercetin 5,3'-dimethyl ether;3,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-4H-1-benzopyran-4-one
CAS_RN	40554-94-7
FORMULA	C17H14O7
EXACTMASS	330.073952802
AVERAGEMASS	330.28886
SMILES	COc(c(O)3)cc(cc3)C(O1)=C(O)C(=O)c(c(OC)2)c(cc(O)c2)1
M  END

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