Mol:FL1CHYNI0002

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

FL1CHYNI0002.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 26  0  0  0  0  0  0  0  0999 V2000 
   -1.6765    1.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6765    0.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1202    0.1555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5639    0.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5639    1.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1202    1.4403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0076    0.1555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5487    0.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1048    0.1557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6609    0.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2219    0.1528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7829    0.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7829    1.1245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2219    1.4484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6609    1.1245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0076   -0.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1048   -0.4851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2328    0.1555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2328   -0.4866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7889   -0.8076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3438   -0.4873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7889   -1.4484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2326    1.4401    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0078    1.4401    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3438    1.4483    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 
  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 11  2  0  0  0  0 
 11 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 10  1  0  0  0  0 
  7 16  2  0  0  0  0 
  9 17  2  0  0  0  0 
 18  2  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 20 22  1  0  0  0  0 
  1 23  1  0  0  0  0 
  5 24  1  0  0  0  0 
 13 25  1  0  0  0  0 
S  SKP  8 
ID	FL1CHYNI0002 
KNApSAcK_ID	C00007004 
NAME	5'-Prenyllicodione 
CAS_RN	107390-47-6 
FORMULA	C20H20O5 
EXACTMASS	340.13107375 
AVERAGEMASS	340.3698 
SMILES	c(c1)(C(CC(=O)c(c2)ccc(O)c2)=O)c(cc(O)c1CC=C(C)C)O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox