Mol:FL5FA9NI0002

From Metabolomics.JP
(Difference between revisions)
Jump to: navigation, search

Revision as of 09:00, 7 October 2008

FL5FA9NI0002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.1253    0.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1253   -0.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5690   -0.3331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0127   -0.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0127    0.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5690    0.9516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5436   -0.3331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0999   -0.0119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0999    0.6304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5436    0.9516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5436   -0.8340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6560    0.9515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2230    0.6241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7900    0.9515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7900    1.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2230    1.9335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6560    1.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5684   -0.8752    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7370    0.9395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6797   -0.3183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6814   -0.3330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6814   -0.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2363   -1.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2363   -1.9335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7900   -0.9744    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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 18  3  1  0  0  0  0
 19  1  1  0  0  0  0
  8 20  1  0  0  0  0
  2 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
S  SKP  8
ID	FL5FA9NI0002
KNApSAcK_ID	C00004988
NAME	3,5,7-Trihydroxy-6-prenylflavone
CAS_RN	51948-71-1
FORMULA	C20H18O5
EXACTMASS	338.115423686
AVERAGEMASS	338.35392
SMILES	C(c(c3O)c(O)cc(c32)OC(=C(C2=O)O)c(c1)cccc1)C=C(C)C
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox