Mol:LBF21307PG10

From Metabolomics.JP
Jump to: navigation, search

LBF21307PG10.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 26  0  0  0  0  0  0  0  0999 V2000 
    9.0858    3.8649    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    8.7768    2.9139    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    9.5858    2.3261    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
   10.3948    2.9139    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
   10.0858    3.8649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.5858    1.3261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.8257    2.6048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0826    3.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.1315    2.9650    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    5.3884    3.6341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4373    3.3251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6942    3.9942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7431    3.6852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    4.3543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.4518    0.8261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.4518   -0.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.3179   -0.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.3179   -1.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.1839   -2.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.1839   -3.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.0499   -4.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.3459    2.6048    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.9236    1.9868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.4980    4.6739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   13.0499   -3.6739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   11.3179   -3.6739    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 
  4  5  1  0  0  0  0 
  5  1  1  0  0  0  0 
  3  6  1  6  0  0  0 
  7  8  2  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 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 
  2  7  1  1  0  0  0 
  6 15  1  0  0  0  0 
 15 16  2  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 
  1 24  1  6  0  0  0 
  4 22  1  6  0  0  0 
  9 23  1  1  0  0  0 
 20 25  1  0  0  0  0 
 20 26  2  0  0  0  0 
 25 21  1  0  0  0  0 
S  SKP  5 
ID	LBF21307PG10 
FORMULA	C21H36O5 
EXACTMASS	368.256274262 
AVERAGEMASS	368.50754 
SMILES	C(CC[C@H](O)C=C[C@H]([C@H]1CC=CCCCC(OC)=O)[C@@H](C[C@@H]1O)O)CC 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox