Mol:FL2FBANC0012

From Metabolomics.JP
Jump to: navigation, search

FL2FBANC0012.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 43 48  0  0  0  0  0  0  0  0999 V2000 
   -0.3729   -2.6732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0805   -2.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3485   -2.2730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3619   -1.4477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3457   -1.0234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0669   -1.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3321   -0.1985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0396    0.2257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7608   -0.1749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7744   -0.9998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4095    0.2145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3954    1.0394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1027    1.4640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8241    1.0638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8382    0.2389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1309   -0.1857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.4114    1.4164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3857   -3.4191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2155   -3.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0514   -2.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7745   -2.3019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7895   -1.4795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0849   -1.0495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0375   -3.3858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2969    0.1478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3122    0.9035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8764    1.2142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3068    1.2778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2904    2.0838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0299    2.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0132    3.3558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7191    3.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4418    3.3847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4585    2.5599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7526    2.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9656    3.7015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3869   -1.1505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0928   -1.5774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8155   -1.1795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8322   -0.3546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1263    0.0722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4036   -0.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4114   -0.0357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  1  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  2  1  0  0  0  0 
  5  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  6  1  0  0  0  0 
  9 11  1  1  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 
 18 19  1  0  0  0  0 
  3 20  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  4  1  0  0  0  0 
 20 24  2  0  0  0  0 
  7 25  1  1  0  0  0 
 25 26  1  0  0  0  0 
 26 27  1  6  0  0  0 
 26 28  1  0  0  0  0 
 28 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
 30 31  2  0  0  0  0 
 31 32  1  0  0  0  0 
 32 33  2  0  0  0  0 
 33 34  1  0  0  0  0 
 34 35  2  0  0  0  0 
 35 30  1  0  0  0  0 
 33 36  1  0  0  0  0 
 22 37  1  0  0  0  0 
 37 38  2  0  0  0  0 
 38 39  1  0  0  0  0 
 39 40  2  0  0  0  0 
 40 41  1  0  0  0  0 
 41 42  2  0  0  0  0 
 42 37  1  0  0  0  0 
 40 43  1  0  0  0  0 
S  SKP  8 
ID	FL2FBANC0012 
KNApSAcK_ID	C00014296 
NAME	Epicalyxin M 
CAS_RN	332396-26-6 
FORMULA	C35H34O8 
EXACTMASS	582.225368064 
AVERAGEMASS	582.63966 
SMILES	O(c52)C(CC(CC(O)CCc(c6)ccc(c6)O)c2c(c(c(c5)OC)4)OC(CC(=O)4)c(c3)ccc(c3)O)c(c1)ccc(O)c1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox