Mol:FL5FDAGS0007

From Metabolomics.JP
Revision as of 09:00, 14 March 2009 by Editor (Talk | contribs)

(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to: navigation, search

FL5FDAGS0007.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 45 49  0  0  0  0  0  0  0  0999 V2000 
    2.1945   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4801   -1.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4801   -0.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1945    0.1756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9090   -0.2368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9090   -1.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7657   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0512   -1.0618    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6633   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6633   -2.2993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0512   -2.7118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7657   -2.2993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3777   -1.0618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0921   -1.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0921   -2.2993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3777   -2.7118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0512   -3.5367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8066   -1.0618    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4801   -2.7118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3777   -3.5367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5199    0.1158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1905    0.8587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6542    3.1626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4358    2.3668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1457    1.9459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5419    1.2220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7605    2.0178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0506    2.4388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1315    3.0433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7040    3.5367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1373    3.3304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0381    2.8253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9838    1.1011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5931    1.6278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3914    1.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6725    1.0140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2603    0.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5382    0.5078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1808    0.9129    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8168   -0.1913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6024    0.9825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5747    1.9429    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1549    2.0423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1933   -2.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5199   -1.4736    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 
  2  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12  7  2  0  0  0  0 
  9 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 10  1  0  0  0  0 
 14 18  1  0  0  0  0 
 11 17  2  0  0  0  0 
 12 19  1  0  0  0  0 
 16 20  1  0  0  0  0 
  5 21  1  0  0  0  0 
  4 22  1  0  0  0  0 
 23 24  1  1  0  0  0 
 24 25  1  1  0  0  0 
 26 25  1  1  0  0  0 
 26 27  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 23  1  0  0  0  0 
 28 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
 23 31  1  0  0  0  0 
 24 32  1  0  0  0  0 
 25 33  1  0  0  0  0 
 34 35  1  0  0  0  0 
 35 36  1  1  0  0  0 
 37 36  1  1  0  0  0 
 38 37  1  1  0  0  0 
 38 39  1  0  0  0  0 
 39 34  1  0  0  0  0 
 37 40  1  0  0  0  0 
 36 41  1  0  0  0  0 
 35 42  1  0  0  0  0 
 34 43  1  0  0  0  0 
 38 33  1  0  0  0  0 
 26 22  1  0  0  0  0 
 19 44  1  0  0  0  0 
 18 45  1  0  0  0  0 
S  SKP  5 
ID	FL5FDAGS0007 
FORMULA	C29H34O16 
EXACTMASS	638.18468504 
AVERAGEMASS	638.57066 
SMILES	OC(C(O)4)C(OC(C5O)OC(C)C(C5O)O)C(OC4CO)Oc(c3O)cc(cc3)C(O1)=C(OC)C(=O)c(c(O)2)c1cc(c2)OC 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox