Mol:FL1C1ANI0030

From Metabolomics.JP
Jump to: navigation, search

FL1C1ANI0030.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 30 31  0  0  0  0  0  0  0  0999 V2000 
   -1.7862    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006   -0.6188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    1.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2151    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2151   -0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9296    1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9296    1.8562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.6441    0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    1.8563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2151   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9296   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9296    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2151    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6441   -0.6188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2151   -1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006   -1.8563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862   -1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717   -1.8563    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 
  6  8  1  0  0  0  0 
  1  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 12 14  1  0  0  0  0 
  5 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 15 17  1  0  0  0  0 
 17 18  2  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  2  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 
 23 24  2  0  0  0  0 
 24 19  1  0  0  0  0 
 22 25  1  0  0  0  0 
 21 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 28  2  0  0  0  0 
 28 29  1  0  0  0  0 
 28 30  1  0  0  0  0 
S  SKP  8 
ID	FL1C1ANI0030 
KNApSAcK_ID	C00014455 
NAME	Paratocarpin E;3-Prenyl-3'-(2-hydroxy-3-methylbutyl-3-enyl)-4,2',4'-trihydroxychalcone 
CAS_RN	161099-60-1 
FORMULA	C25H28O5 
EXACTMASS	408.193674006 
AVERAGEMASS	408.48682 
SMILES	Oc(c2CC(C(C)=C)O)ccc(c2O)C(C=Cc(c1)cc(c(O)c1)CC=C(C)C)=O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox