Mol:FLIDHXNS0010

From Metabolomics.JP
Revision as of 09:00, 14 March 2009 by Editor (Talk | contribs)

(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to: navigation, search

FLIDHXNS0010.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 27  0  0  0  0  0  0  0  0999 V2000 
   -2.2357    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2357    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6794   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1231    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1231    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6794    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5668   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0105    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0105    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5668    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5456   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5456   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1404   -1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7352   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7352   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1404    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5610   -0.8138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7920    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5429    0.5133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3883   -1.0262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7920   -0.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3883    0.0850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1404    0.9023    0.0000 O   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 
 12 17  1  0  0  0  0 
  1 18  1  0  0  0  0 
  8 19  1  0  0  0  0 
 14 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 15  1  0  0  0  0 
 16 23  1  0  0  0  0 
S  SKP  8 
ID	FLIDHXNS0010 
KNApSAcK_ID	C00009679 
NAME	6a,7-Dihydroxymaackiain;3,6a,7-Trihydroxy-8,9-methylenedioxypterocarpan 
CAS_RN	61135-99-7 
FORMULA	C16H12O7 
EXACTMASS	316.058302738 
AVERAGEMASS	316.26228000000003 
SMILES	Oc(c5)cc(O4)c(c5)C(O1)C(O)(C4)c(c(O)2)c(cc(O3)c(OC3)2)1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox