Mol:FL2FA8NI0006

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

FL2FA8NI0006.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 27  0  0  0  0  0  0  0  0999 V2000
   -2.1425   -0.4158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1403   -1.2383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4233   -1.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7117   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7118   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4272   -0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0064   -1.6499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7173   -1.2373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7154   -0.4092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0026    0.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4298    0.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1426   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570    0.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8569    0.8316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1424    1.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4280    0.8313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0064   -2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8570   -0.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1420    2.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1420    1.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4272    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8566    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4276    2.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1426   -1.1282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4233   -2.3503    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
  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  6  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
  6 21  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 19 23  1  0  0  0  0
 12 24  1  0  0  0  0
  3 25  1  0  0  0  0
S  SKP  8
ID	FL2FA8NI0006
KNApSAcK_ID	C00014156
NAME	Kushenol S;5,7,2'-Trihydroxy-8-prenylflavanone
CAS_RN	254886-72-1
FORMULA	C20H20O5
EXACTMASS	340.13107375
AVERAGEMASS	340.3698
SMILES	c(C(C3)Oc(c(CC=C(C)C)2)c(C(=O)3)c(cc(O)2)O)(c(O)1)cccc1
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox