Mol:FL2FACGS0005

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 34  0  0  0  0  0  0  0  0999 V2000 
   -1.5203   -0.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5203   -1.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8058   -1.5046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0912   -1.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0912   -0.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8058    0.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6233   -1.5046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3378   -1.0921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3378   -0.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6233    0.1455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0520    0.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7803   -0.2751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5086    0.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5086    0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7803    1.4067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0520    0.9862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6233   -2.2030    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.2366    1.4066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2345    0.1454    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7803    2.3294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.6680    0.3027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9935   -0.0867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2076    0.6622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9935    1.4158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.6680    1.8053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4541    1.0562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2378    2.2356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9935    1.9018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9563    1.4650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.2366    0.2517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8058   -2.3294    0.0000 O   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  1  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 
 14 18  1  0  0  0  0 
  1 19  1  0  0  0  0 
 20 15  1  0  0  0  0 
 22 21  1  1  0  0  0 
 22 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 26  1  1  0  0  0 
 26 21  1  1  0  0  0 
 25 27  1  0  0  0  0 
 24 28  1  0  0  0  0 
 26 29  1  0  0  0  0 
 21 30  1  0  0  0  0 
 22 19  1  0  0  0  0 
  3 31  1  0  0  0  0 
S  SKP  5 
ID	FL2FACGS0005 
FORMULA	C21H22O10 
EXACTMASS	434.121296924 
AVERAGEMASS	434.39338 
SMILES	c(c1)c(C(C4)Oc(c3C(=O)4)cc(cc(O)3)OC(O2)C(O)C(O)C(O)C(C)2)cc(c(O)1)O 
M  END