Mol:FL3F98NS0003

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

FL3F98NS0003.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 20 22  0  0  0  0  0  0  0  0999 V2000
   -1.9576    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9576   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4013   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8450   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8450    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4013    0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2887   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2676   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2676    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2887    0.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2887   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8237    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907    0.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9576    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9576    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907    1.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8237    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4013   -1.3429    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9596   -0.0893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6741   -0.5018    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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 17  2  0  0  0  0
 17 12  1  0  0  0  0
  3 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1 OCH3
M  SBV   1 21   -4.8389    2.5983
S  SKP  8
ID	FL3F98NS0003
KNApSAcK_ID	C00003797
NAME	5-Hydroxy-2'-methoxyflavone
CAS_RN	6665-71-0
FORMULA	C16H12O4
EXACTMASS	268.073558872
AVERAGEMASS	268.26408
SMILES	COc(c3)c(ccc3)C(=C1)Oc(c2)c(c(O)cc2)C(=O)1
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox