Mol:FL6FAAGS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 31  0  0  0  0  0  0  0  0999 V2000 
   -1.5981    0.5523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5981   -0.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8836   -0.6851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1692   -0.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1692    0.5523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8836    0.9649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5453   -0.6851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2597   -0.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2597    0.5523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5453    0.9649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9742    0.9649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6946    0.5489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4150    0.9649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4150    1.7967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6946    2.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9742    1.7967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1344    2.2120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3124    0.9649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5507   -1.4430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0387   -2.1188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3015   -1.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5902   -1.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1072   -1.3074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7521   -1.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.1344   -1.7505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.6293   -2.1590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5891   -2.2125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8868   -1.4958    0.0000 O   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  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  9 11  1  6  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 
 14 17  1  0  0  0  0 
  1 18  1  0  0  0  0 
 19 20  1  1  0  0  0 
 20 21  1  1  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 19  1  0  0  0  0 
 19 25  1  0  0  0  0 
 20 26  1  0  0  0  0 
 21 27  1  0  0  0  0 
 22 28  1  0  0  0  0 
 28  3  1  0  0  0  0 
S  SKP  5 
ID	FL6FAAGS0001 
FORMULA	C20H22O8 
EXACTMASS	390.13146768 
AVERAGEMASS	390.38388000000003 
SMILES	C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)ccc(O)c2)C(O)C(C(O)C1)O 
M  END