Mol:FLIDHXNI0004

From Metabolomics.JP
Jump to: navigation, search

FLIDHXNI0004.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 28  0  0  0  0  0  0  0  0999 V2000 
   -2.0044   -0.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0044   -0.7488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481   -1.0700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8918   -0.7488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8918   -0.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481    0.2147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3355   -1.0700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2208   -0.7488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2208   -0.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3355    0.2147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7769   -1.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7769   -1.7567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3717   -2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9665   -1.7567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9665   -1.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3717   -0.7265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3296   -1.7565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5607    0.2147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5607   -2.0998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7769   -0.4278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4481    0.8568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8920    1.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8920    1.7928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4243    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3597    2.1001    0.0000 C   0  0  0  0  0  0  0  0  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 
  8 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  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 11  2  0  0  0  0 
  7 17  1  0  0  0  0 
  1  2  1  0  0  0  0 
 18  1  1  0  0  0  0 
 12 17  1  0  0  0  0 
 14 19  1  0  0  0  0 
  8 20  1  0  0  0  0 
  6 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
S  SKP  8 
ID	FLIDHXNI0004 
KNApSAcK_ID	C00009689 
NAME	Glyceollidin I;3,6a,9-Trihydroxy-4-prenylpterocarpan 
CAS_RN	77979-21-6 
FORMULA	C20H20O5 
EXACTMASS	340.13107375 
AVERAGEMASS	340.3698 
SMILES	C(c(c4O)c(c(cc4)1)OCC(O)(c32)C1Oc2cc(O)cc3)C=C(C)C 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox