Mol:FL2FALNI0028

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

FL2FALNI0028.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 31 33  0  0  0  0  0  0  0  0999 V2000
   -1.3434   -1.8029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8225   -2.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3016   -1.8029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3016   -1.2015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8225   -0.9007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3434   -1.2015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2193   -2.1037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7402   -1.8029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7402   -1.2015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2193   -0.9007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2605   -0.9010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2193   -2.6276    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7949   -1.2095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3293   -0.9010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3293   -0.2840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7949    0.0245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2605   -0.2840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8225   -2.7045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8627    0.0240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8637   -0.9010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8225   -0.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3429    0.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3429    0.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8632    0.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7271    0.0240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8632    1.5028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3836    1.8032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3836    2.4041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8627    2.6807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8225    0.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8632    2.7045    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
 15 19  1  0  0  0  0
  6 20  1  0  0  0  0
  5 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
 17 25  1  0  0  0  0
 24 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
 23 30  1  0  0  0  0
 28 31  1  0  0  0  0
S  SKP  8
ID	FL2FALNI0028
KNApSAcK_ID	C00013590
NAME	Sophoraflavanone C
CAS_RN	121927-91-1
FORMULA	C25H28O6
EXACTMASS	424.188588628
AVERAGEMASS	424.48622
SMILES	c(CC=C(C)CCC=C(C)C)(c(O)3)c(O1)c(c(c3)O)C(=O)CC1c(c2)c(O)cc(O)c2
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox