Mol:FL5FE8NS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
   -0.7138   -0.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7138    0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4283    0.6186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1428    0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1427   -0.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4283   -1.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0007   -1.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7152   -0.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7151    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0007    0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4295    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1440    0.2064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8584    0.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8584    1.4439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1439    1.8564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4294    1.4439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0007   -1.8564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8572    0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4296   -1.0314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5705    0.2068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8572   -1.0314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5717   -0.6189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4283   -1.8564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1440   -0.6172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5717    0.2071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4296   -1.7609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
  1  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  2  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 
  4 18  1  0  0  0  0 
  8 19  1  0  0  0  0 
 18 20  1  0  0  0  0 
  5 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
  6 23  1  0  0  0  0 
 12 24  1  0  0  0  0 
 13 25  1  0  0  0  0 
 19 26  1  0  0  0  0 
S  SKP  8 
ID	FL5FE8NS0002 
KNApSAcK_ID	C00013366 
NAME	5,2',3'-Trihydroxy-3,6,7-trimethoxyflavone 
CAS_RN	- 
FORMULA	C18H16O8 
EXACTMASS	360.08451748799996 
AVERAGEMASS	360.31484 
SMILES	c(c3OC)c(O1)c(c(c3OC)O)C(C(=C1c(c(O)2)cccc2O)OC)=O 
M  END