Mol:FL2FALNI0001

From Metabolomics.JP
Revision as of 09:00, 14 March 2009 by Editor (Talk | contribs)

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

FL2FALNI0001.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
   -3.9355    0.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9355   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3792   -0.8123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8229   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8229    0.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3792    0.4725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2666   -0.8123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7103   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7103    0.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2666    0.4725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1542    0.4723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5872    0.1450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0203    0.4723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0203    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5872    1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1542    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2666   -1.3560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3792   -1.4544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.4916    0.4723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5465    1.4543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7210    1.4543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5465    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1122    0.4717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6778    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2422    0.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6778   -0.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8055    0.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3675    0.4703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9296    0.1458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4916    0.4703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9296   -0.5032    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  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  9 11  1  0  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 
  3 18  1  0  0  0  0 
  1 19  1  0  0  0  0 
 14 20  1  0  0  0  0 
 16 21  1  0  0  0  0 
 13 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 
 25 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 
S  SKP  8 
ID	FL2FALNI0001 
KNApSAcK_ID	C00008328 
NAME	Kuwanon E 
CAS_RN	68401-05-8 
FORMULA	C25H28O6 
EXACTMASS	424.188588628 
AVERAGEMASS	424.48622 
SMILES	c(c3CC=C(C)CCC=C(C)C)c(c(cc(O)3)O)C(O2)CC(c(c12)c(cc(c1)O)O)=O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox