Mol:FL2FALNI0006

From Metabolomics.JP
Jump to: navigation, search

FL2FALNI0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
   -1.4685   -1.4446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4685   -2.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9122   -2.4081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3559   -2.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3559   -1.4446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9122   -1.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2004   -2.4081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7567   -2.0869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7567   -1.4446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2004   -1.1234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3128   -1.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8798   -1.4509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4468   -1.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4468   -0.4688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8798   -0.1415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3128   -0.4688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2004   -2.9519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9122   -3.0502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0136   -0.1416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0246   -1.1235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9122    0.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7460   -0.1416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6132    0.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6132    1.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3134    0.2205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0136    0.6247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3134   -0.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3134    1.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3134    2.6460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0136    3.0502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6132    3.0502    0.0000 C   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  5  1  0  0  0  0 
  9 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  7 17  2  0  0  0  0 
  3 18  1  0  0  0  0 
 14 19  1  0  0  0  0 
  1 20  1  0  0  0  0 
  6 21  1  0  0  0  0 
 16 22  1  0  0  0  0 
 21 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
 25 26  2  0  0  0  0 
 25 27  1  0  0  0  0 
 24 28  1  0  0  0  0 
 28 29  2  0  0  0  0 
 29 30  1  0  0  0  0 
 29 31  1  0  0  0  0 
S  SKP  8 
ID	FL2FALNI0006 
KNApSAcK_ID	C00008364 
NAME	Sophoraflavanone G 
CAS_RN	97938-30-2 
FORMULA	C25H28O6 
EXACTMASS	424.188588628 
AVERAGEMASS	424.48622 
SMILES	c(c3O)c(c(C(=O)1)c(c3CC(C(C)=C)CC=C(C)C)OC(c(c2)c(O)cc(O)c2)C1)O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox