Mol:FL3FA9NS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 21 23  0  0  0  0  0  0  0  0999 V2000 
   -1.6027    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6027   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1022   -0.7485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6018   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6018    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1022    0.4073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1013   -0.7485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3991   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3991    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1013    0.4073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8992    0.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4296    0.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9599    0.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9599    1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4296    1.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8992    1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1013   -1.3257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9599    0.7371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4598    1.6032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5666   -0.8929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8522   -1.3054    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 
 10  5  1  0  0  0  0 
  9 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  7 17  2  0  0  0  0 
  1 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
  3 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  20  21 
M  SBL   2  1  22 
M  SMT   2  OCH3 
M  SVB   2 22   -1.5666   -0.8929 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  18  19 
M  SBL   1  1  20 
M  SMT   1  OCH3 
M  SVB   1 20   -1.9599    0.7371 
S  SKP  8 
ID	FL3FA9NS0001 
KNApSAcK_ID	C00001028 
NAME	5,7-Dimethoxyflavone;chrysin 5,7-dimethyl ether 
CAS_RN	21392-57-4 
FORMULA	C17H14O4 
EXACTMASS	282.089208936 
AVERAGEMASS	282.29066 
SMILES	COc(c1)cc(O2)c(C(=O)C=C2c(c3)cccc3)c(OC)1 
M  END