Mol:FL5FA8NS0005

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
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    1.6742    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -3.0984    1.6360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5402   -0.0277    0.0000 O   0  0  0  0  0  0  0  0  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    1.8838    0.2661 
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   -2.5983      0.77 
S  SKP  8 
ID	FL5FA8NS0005 
KNApSAcK_ID	C00004628 
NAME	3,5,2'-Trihydroxy-7,5'-dimethoxyflavone;3,5-Dihydroxy-2-(2-hydroxy-5-methoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one 
CAS_RN	74161-18-5 
FORMULA	C17H14O7 
EXACTMASS	330.073952802 
AVERAGEMASS	330.28886 
SMILES	COc(c3)cc(c(O)c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(OC)c2)1 
M  END