Mol:FL1CAANI0001

From Metabolomics.JP
Revision as of 09:00, 7 October 2008 by Editor (Talk | contribs)

(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to: navigation, search

FL1CAANI0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 26  0  0  0  0  0  0  0  0999 V2000
    2.3281    0.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3281   -0.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8844   -0.3412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4407   -0.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4407    0.6223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8844    0.9435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0712   -0.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6275   -0.3412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5151   -0.3411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0459   -0.0075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5151   -0.9818    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0459    0.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5985    0.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1511    0.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1511   -0.0075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5985   -0.3265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5985   -0.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9970    0.9435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4917    0.9410    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3430    0.6635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8944    0.9818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4457    0.6635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9970    0.9818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4457    0.0269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7037    0.9497    0.0000 O   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
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  2  8  1  0  0  0  0
 10 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 10  1  0  0  0  0
 16 17  1  0  0  0  0
 18  5  1  0  0  0  0
 12 19  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
 14 25  1  0  0  0  0
 20 25  1  0  0  0  0
S  SKP  8
ID	FL1CAANI0001
KNApSAcK_ID	C00007101
NAME	4,2',6'-Trihydroxy-4'-prenyloxychalcone
CAS_RN	94393-11-0
FORMULA	C20H20O5
EXACTMASS	340.13107375
AVERAGEMASS	340.3698
SMILES	Oc(c2)ccc(c2)C=CC(c(c1O)c(cc(c1)OCC=C(C)C)O)=O
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox