Mol:FL5FFANS0008

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FL5FFANS0008.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
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    1.9942   -1.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1286    1.0455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6920    1.9451    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
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  9 10  1  0  0  0  0
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  9 12  1  0  0  0  0
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  1 18  1  0  0  0  0
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  8 21  1  0  0  0  0
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  6 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   -1.1286    1.0455
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    0.4611   -0.6973
S  SKP  8
ID	FL5FFANS0008
KNApSAcK_ID	C00004615
NAME	Herbacetin 3,8-dimethyl ether;5,7,4'-Trihydroxy-3,8-dimethoxyflavone;3,8-Dimethylherbacetin;5,7-Dihydroxy-2-(4-hydroxyphenyl)-3,8-dimethoxy-4H-1-benzopyran-4-one
CAS_RN	14965-09-4
FORMULA	C17H14O7
EXACTMASS	330.073952802
AVERAGEMASS	330.28886
SMILES	COc(c(O)3)c(O1)c(c(O)c3)C(=O)C(OC)=C(c(c2)ccc(O)c2)1
M  END

</pre>

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