Mol:FL2FALNI0031

From Metabolomics.JP
Jump to: navigation, search

FL2FALNI0031.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 30  0  0  0  0  0  0  0  0999 V2000 
   -2.4974   -0.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4788   -1.2392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7017   -1.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0468   -1.2233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0327   -0.3984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7583    0.0266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2919   -1.6488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3819   -1.2478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3727   -0.3815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3112    0.0018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0872    0.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7782   -0.3554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4896    0.0430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5101    0.8678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7983    1.2976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0779    0.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2919   -2.4737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2119   -0.0228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7017   -2.4489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2119    1.2730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7583    0.8120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7983    2.0660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5044    2.4737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7782   -1.1557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5282    1.2565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5282    2.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8775    2.3924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0788    2.3346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  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 
  1 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
 14 20  1  0  0  0  0 
  6 21  1  0  0  0  0 
 15 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 12 24  1  0  0  0  0 
 21 25  1  0  0  0  0 
 25 26  2  0  0  0  0 
 26 27  1  0  0  0  0 
 26 28  1  0  0  0  0 
S  SKP  8 
ID	FL2FALNI0031 
KNApSAcK_ID	C00014170 
NAME	Kushenol W;5,7,2',4'-Tetrahydroxy-5'-methoxy-8-prenylflavanone 
CAS_RN	254886-76-5 
FORMULA	C21H22O7 
EXACTMASS	386.136553058 
AVERAGEMASS	386.39518 
SMILES	O(C(c(c3)c(cc(O)c3OC)O)2)c(c(CC=C(C)C)1)c(C(=O)C2)c(cc(O)1)O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox