Mol:FL5FEANS0009

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
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    1.9523    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -2.3202    0.7700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8202    1.6360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1282   -0.9911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  1  2  1  0  0  0  0 
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  3  4  1  0  0  0  0 
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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    0.4611   -0.6973 
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   -2.3202      0.77 
S  SKP  8 
ID	FL5FEANS0009 
KNApSAcK_ID	C00004597 
NAME	5,6,4'-Trihydroxy-3,7-dimethoxyflavone;6-Hydroxykaempferol 3,7-dimethyl ether;5,6-Dihydroxy-2-(4-hydroxyphenyl)-3,7-dimethoxy-4H-1-benzopyran-4-one 
CAS_RN	56226-95-0 
FORMULA	C17H14O7 
EXACTMASS	330.073952802 
AVERAGEMASS	330.28886 
SMILES	COc(c1)c(O)c(O)c(C(=O)2)c1OC(c(c3)ccc(O)c3)=C(OC)2 
M  END