Mol:FL5FAKGS0002

From Metabolomics.JP
Revision as of 09:00, 7 October 2008 by Editor (Talk | contribs)

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

FL5FAKGS0002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 36 39  0  0  0  0  0  0  0  0999 V2000
    1.4456    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7311    0.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7311    1.8195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4456    2.2320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1600    1.8195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1600    0.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0166    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6979    0.9945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4123    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4123   -0.2430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6978   -0.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0166   -0.2430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1268    0.9945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8413    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8413   -0.2430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1268   -0.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6978   -1.3625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5557    0.9945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7922   -0.7351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1268   -1.3465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8745    2.2320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4456    3.0570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8379    0.6031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5557    1.8387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5023    0.9867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6800   -2.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0186   -2.9088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6322   -2.4013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4508   -2.2964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7894   -1.8027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1385   -2.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2371   -1.8339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7873   -1.7689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9331   -3.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5331   -2.8481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7274   -3.0570    0.0000 O   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
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
  9 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 10  1  0  0  0  0
 14 18  1  0  0  0  0
 11 17  2  0  0  0  0
 12 19  1  0  0  0  0
 16 20  1  0  0  0  0
  5 21  1  0  0  0  0
  4 22  1  0  0  0  0
  6 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
 26 27  1  1  0  0  0
 27 28  1  1  0  0  0
 29 28  1  1  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 26  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 26 34  1  0  0  0  0
 27 35  1  0  0  0  0
 28 36  1  0  0  0  0
 29 19  1  0  0  0  0
S  SKP  8
ID	FL5FAKGS0002
KNApSAcK_ID	C00013983
NAME	Myricetin 3',4'-dimethyl ether 3-glucoside;3-(beta-D-Glucopyranosyloxy)-5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN	244775-37-9
FORMULA	C23H24O13
EXACTMASS	508.121690854
AVERAGEMASS	508.42886
SMILES	O(C(O4)C(O)C(C(C(CO)4)O)O)C(C3=O)=C(Oc(c32)cc(cc2O)O)c(c1)cc(O)c(OC)c1OC
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox