Mol:FL2FAANP0011

From Metabolomics.JP
Jump to: navigation, search

FL2FAANP0011.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 30 33  0  0  0  0  0  0  0  0999 V2000 
   -1.8623   -0.9527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8438   -1.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0666   -2.1417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4118   -1.7406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3976   -0.9158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1233   -0.4907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3432   -2.1661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0170   -1.7652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0077   -0.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3239   -0.5156    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7222   -0.4863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4156   -0.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1356   -0.4983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1291    0.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4258    0.7845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7078    0.3800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3432   -2.9079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8394    0.7434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0666   -2.8783    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4258    1.5159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7823    1.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7823    2.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3660    2.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2151    2.8983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5677   -0.5669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2546   -0.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2360   -1.7887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5306   -2.1745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.7383   -0.5011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8394   -1.1416    0.0000 C   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 
 18 14  1  0  0  0  0 
  3 19  1  0  0  0  0 
 15 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  2  0  0  0  0 
 22 23  1  0  0  0  0 
 22 24  1  0  0  0  0 
  1 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 28  2  0  0  0  0 
 28  2  1  0  0  0  0 
 26 29  1  0  0  0  0 
 26 30  1  0  0  0  0 
S  SKP  8 
ID	FL2FAANP0011 
KNApSAcK_ID	C00014235 
NAME	Paratocarpin I;5,4'-Dihydroxy-3'-prenyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone 
CAS_RN	170662-23-4 
FORMULA	C25H26O5 
EXACTMASS	406.178023942 
AVERAGEMASS	406.47094 
SMILES	c(c34)(OC(C=C4)(C)C)cc(c(c3O)2)OC(CC(=O)2)c(c1)cc(c(c1)O)CC=C(C)C 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox