Mol:FL2FA9GS0005

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 43 47  0  0  0  0  0  0  0  0999 V2000 
    0.1416    1.3679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1416    0.5585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8426    0.1538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5436    0.5585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5436    1.3679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8426    1.7728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2447    0.1538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9457    0.5585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9457    1.3679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2447    1.7728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6465    1.7726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.3610    1.3601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0756    1.7726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0756    2.5977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.3610    3.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6465    2.5977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2447   -0.5315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5592    1.7726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8426   -0.6554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8472    1.3050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4984    1.9564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2986    1.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.2195    1.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5683    0.8488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7681    1.3050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.3081    0.8475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.7681    1.2851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0141    0.7985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3683   -0.9070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8796   -0.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8194   -0.3291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.7651   -0.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.2539   -0.9070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3139   -0.6384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.5268   -0.1365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.7584   -0.6156    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9462   -1.3676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9462   -2.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9462   -3.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1965   -2.1349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3813   -1.6398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8703    1.9113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.0756    2.2794    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 
  1 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
 20 18  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  1  1  0  0  0 
 24 25  1  1  0  0  0 
 20 25  1  1  0  0  0 
 24 26  1  0  0  0  0 
 23 27  1  0  0  0  0 
 25 28  1  0  0  0  0 
 30 29  1  1  0  0  0 
 30 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
 32 33  1  0  0  0  0 
 33 34  1  1  0  0  0 
 29 34  1  1  0  0  0 
 28 30  1  0  0  0  0 
 32 35  1  0  0  0  0 
 33 36  1  0  0  0  0 
 37 38  1  0  0  0  0 
 38 39  1  0  0  0  0 
 38 40  2  0  0  0  0 
 29 41  1  0  0  0  0 
 34 37  1  0  0  0  0 
 42 43  1  0  0  0  0 
 22 42  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  42  43 
M  SBL   1  1  47 
M  SMT   1 ^ CH2OH 
M  SBV   1  47    0.5717   -0.4110 
S  SKP  5 
ID	FL2FA9GS0005 
FORMULA	C29H34O14 
EXACTMASS	606.194855796 
AVERAGEMASS	606.57186 
SMILES	C(C(C)1)(C(OC(C)=O)C(C(OC(C5O)C(OC(C5O)CO)Oc(c4)cc(O2)c(c(O)4)C(CC(c(c3)cccc3)2)=O)O1)O)O 
M  END