Mol:LBF16306HO01

From Metabolomics.JP
Jump to: navigation, search

LBF16306HO01.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 19 18  0  0  1  0  0  0  0  0999 V2000 
   -2.6748    0.4235    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
   -3.0873   -0.2915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6748   -1.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8498   -1.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8498    0.4235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1362    0.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4226    0.4235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1362   -0.5954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4226   -1.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2911   -0.5954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0047   -1.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7183   -0.5954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4024    0.4235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1161    0.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8297    0.4235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2578    1.0065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5433    0.0138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5433   -0.8112    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2578    0.4263    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  2  0  0  0  0 
  1  5  1  0  0  0  0 
  6  5  2  0  0  0  0 
  6  7  1  0  0  0  0 
  4  8  1  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 
  7 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
  1 16  1  1  0  0  0 
 15 17  1  0  0  0  0 
 17 18  2  0  0  0  0 
 17 19  1  0  0  0  0 
S  SKP  5 
ID	LBF16306HO01 
FORMULA	C16H26O3 
EXACTMASS	266.18819469799996 
AVERAGEMASS	266.37584 
SMILES	CCCCCC=CCC(O)C=CC=CCCC(O)=O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox