Mol:FL4DAANI0009

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

FL4DAANI0009.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 36 38  0  0  0  0  0  0  0  0999 V2000
   -2.5154    0.8504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7953    1.2566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5242    0.0275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8113   -0.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0957    0.0094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0845    0.8344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3826   -0.4129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3354   -0.0062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3422    0.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3644    1.2371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0641    1.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0730    2.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7921    2.4492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5004    2.0302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4941    1.2072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7741    0.7993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3976   -1.2377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8263   -1.2182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2222    1.2758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0423   -0.4315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2222    2.4297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7803    2.0815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4887    2.5078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4738    3.3318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7524    3.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1811    3.7574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2010    0.7818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1861   -0.0406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4729   -0.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7778   -0.0170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4577   -1.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7495   -1.6658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7343   -2.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4557   -2.9412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4409   -3.7574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1851   -2.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  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  2  1  0  0  0  0
  5  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  6  1  0  0  0  0
  9 11  1  6  0  0  0
 11 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 11  1  0  0  0  0
  7 17  2  0  0  0  0
  4 18  1  0  0  0  0
  8 20  1  1  0  0  0
  1 19  1  0  0  0  0
 14 21  1  0  0  0  0
  2 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
 15 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
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
S  SKP  8
ID	FL4DAANI0009
KNApSAcK_ID	C00014384
NAME	Sanggenol C;3,5,7,4'-Tetrahydroxy-8-prenyl-3'-geranylflavanone
CAS_RN	174423-32-6
FORMULA	C30H36O6
EXACTMASS	492.251188884
AVERAGEMASS	492.60324
SMILES	c(c32)(c(CC=C(C)C)c(O)cc3O)OC(C(C2=O)O)c(c1)cc(c(O)c1)CC=C(C)CCC=C(C)C
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox