Mol:LBF08000HO03

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

LBF08000HO03.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 11 10  0  0  1  0  0  0  0  0999 V2000
    0.5589    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1419   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7689    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3561   -0.1787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7744    1.0876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0241   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6070    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1901   -0.2626    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.7731    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3561   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1901   -1.0876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  1  6  1  0  0  0  0
  6  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
  8 11  1  4  0  0  0
S  SKP  5
ID	LBF08000HO03
FORMULA	C8H16O3
EXACTMASS	160.109944378
AVERAGEMASS	160.21084
SMILES	CCC(O)CCCCC(O)=O
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox