Mol:FL3FA8GS0007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
   -1.8013    1.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8013    0.1912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0868   -0.2213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3724    0.1912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3724    1.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0868    1.4287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3421   -0.2213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0566    0.1912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0566    1.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3421    1.4287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7710    1.4287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4855    1.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2000    1.4287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2000    2.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4855    2.6662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7710    2.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3421   -1.0463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5209    1.3632    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4855    0.2561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0868   -1.0792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1613    2.6058    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6351   -2.0331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4540   -1.9310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5719   -1.1142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0896   -0.4715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2706   -0.5735    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1526   -1.3903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5519   -1.3070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1100   -1.6413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8922   -2.6662    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0408   -2.2436    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0947   -1.5212    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2000    0.9712    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 
  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 
 18  1  1  0  0  0  0 
 12 19  1  0  0  0  0 
  3 20  1  0  0  0  0 
 16 21  1  0  0  0  0 
 22 23  1  1  0  0  0 
 23 24  1  1  0  0  0 
 25 24  1  1  0  0  0 
 25 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 22  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 29  1  0  0  0  0 
 22 30  1  0  0  0  0 
 23 31  1  0  0  0  0 
 24 32  1  0  0  0  0 
 25 19  1  0  0  0  0 
 18 33  1  0  0  0  0 
S  SKP  8 
ID	FL3FA8GS0007 
KNApSAcK_ID	C00013652 
NAME	5,2',6'-Trihydroxy-7-methoxyflavone 2'-O-glucoside;2-[2-(beta-D-Glucopyranosyloxy)-6-hydroxyphenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one 
CAS_RN	223599-62-0 
FORMULA	C22H22O11 
EXACTMASS	462.116211546 
AVERAGEMASS	462.40348000000006 
SMILES	c(c2)cc(c(C(O4)=CC(c(c43)c(cc(c3)OC)O)=O)c(O)2)OC(C(O)1)OC(CO)C(C1O)O 
M  END