Mol:FL2FACNI0011

From Metabolomics.JP
Jump to: navigation, search

FL2FACNI0011.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
   -1.0451   -1.3238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5242   -1.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0033   -1.3238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0033   -0.7223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5242   -0.4216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0451   -0.7223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5176   -1.6245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0385   -1.3238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0385   -0.7223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5176   -0.4216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5588   -0.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5176   -2.1484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0932   -0.7304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6275   -0.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6275    0.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0932    0.5036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5588    0.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5242   -2.2254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4719   -0.4759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1610    0.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1610   -0.7299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0932    1.1770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6515    1.4993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6515    2.0514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0022    2.2254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1326    2.1804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6148   -1.6527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1774   -1.3279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6815   -1.6190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6815   -2.1910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1610   -1.3422    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 
  3  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  4  1  0  0  0  0 
  9 11  1  0  0  0  0 
  7 12  2  0  0  0  0 
 11 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 11  1  0  0  0  0 
  2 18  1  0  0  0  0 
  6 19  1  0  0  0  0 
 15 20  1  0  0  0  0 
 14 21  1  0  0  0  0 
 16 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 24 25  1  0  0  0  0 
 24 26  1  0  0  0  0 
  1 27  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 29  2  0  0  0  0 
 29 30  1  0  0  0  0 
 29 31  1  0  0  0  0 
S  SKP  8 
ID	FL2FACNI0011 
KNApSAcK_ID	C00008544 
NAME	5,7,3',4'-Tetrahydroxy-6,5'-di-C-prenylflavanone 
CAS_RN	156788-69-1 
FORMULA	C25H28O6 
EXACTMASS	424.188588628 
AVERAGEMASS	424.48622 
SMILES	C(=C(C)C)Cc(c(O)1)cc(C(O2)CC(=O)c(c3O)c2cc(O)c3CC=C(C)C)cc1O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox