Mol:LBF20306HO07

From Metabolomics.JP
Jump to: navigation, search

LBF20306HO07.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 22  0  0  0  0  0  0  0  0999 V2000 
    6.3301   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.5000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.4641   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -5.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5263    6.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    7.5000    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  1  0  0  0  0 
  5  6  2  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 
  1 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  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  1  0  0  0  0 
 17 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 12 21  1  1  0  0  0 
 10 22  1  0  0  0  0 
 10 23  2  0  0  0  0 
S  SKP  5 
ID	LBF20306HO07 
FORMULA	C20H34O3 
EXACTMASS	322.25079495399996 
AVERAGEMASS	322.48216 
SMILES	C(CC=CC[C@H](CCC=CCC=CCCCC(O)=O)O)CCC 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox