Mol:FL1DAAGS0006

From Metabolomics.JP
Jump to: navigation, search

FL1DAAGS0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 37 39  0  0  0  0  0  0  0  0999 V2000 
   -1.7862   -0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717   -1.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -1.2397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717   -0.8272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717   -0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006   -0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2151    0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2151    1.2353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006    1.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    1.2353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -2.0647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    0.4103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9296    1.6478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717   -2.0647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -3.3022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -2.4772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006   -2.0647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006    0.4103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2151   -0.8272    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2151   -0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9296    0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6670    3.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0692    2.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4805    1.8118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2687    1.0141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1337    1.7347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4550    2.3131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0324    2.7482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0404    3.3022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3295    3.2780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0692    3.0195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1179    1.6311    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 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 10  1  0  0  0  0 
  7 16  2  0  0  0  0 
  5 17  1  0  0  0  0 
  1 23  1  0  0  0  0 
  3 19  1  0  0  0  0 
 13 18  1  0  0  0  0 
 19 21  1  0  0  0  0 
 20 21  2  0  0  0  0 
 21 22  1  0  0  0  0 
 23 25  1  0  0  0  0 
 24 25  2  0  0  0  0 
 25 26  1  0  0  0  0 
 27 28  1  1  0  0  0 
 28 29  1  1  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 27  1  0  0  0  0 
 32 33  1  0  0  0  0 
 33 34  1  0  0  0  0 
 27 35  1  0  0  0  0 
 28 36  1  0  0  0  0 
 29 37  1  0  0  0  0 
 17 30  1  0  0  0  0 
S  SKP  8 
ID	FL1DAAGS0006 
KNApSAcK_ID	C00014632 
NAME	Zosterin;4,2'-Dihydroxy-4',6'-diacetoxydihydrochalcone 2'-O-glucoside 
CAS_RN	145039-89-0 
FORMULA	C25H28O12 
EXACTMASS	520.15807636 
AVERAGEMASS	520.48262 
SMILES	C(CC(c(c2OC(C3O)OC(CO)C(O)C3O)c(OC(C)=O)cc(OC(C)=O)c2)=O)c(c1)ccc(O)c1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox