Mol:FLID1CNI0004

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

FLID1CNI0004.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 29 32  0  0  0  0  0  0  0  0999 V2000
   -2.8958   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8958   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395   -1.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7832   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7832   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395    0.1942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2269   -1.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6706   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6706   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2269    0.1942    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1145   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1145   -1.7772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4803   -2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0751   -1.7772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0751   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4803   -0.7470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2252   -1.7770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6693   -2.1203    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4519    0.1941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395    0.8363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8956    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8956    1.7995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4517    2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395    2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6693   -0.7473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2635   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8577   -0.7473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4519   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8577   -0.0612    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  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  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  1  0  0  0  0
 12 17  1  0  0  0  0
 14 18  1  0  0  0  0
  1 19  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 15 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
S  SKP  8
ID	FLID1CNI0004
KNApSAcK_ID	C00010014
NAME	Erybraedin C;(6aR,11aR)-3,9-Dihydroxy-4,8-diprenylpterocarpan
CAS_RN	119269-74-8
FORMULA	C25H28O4
EXACTMASS	392.19875938399997
AVERAGEMASS	392.48742
SMILES	C(c(c4O)cc(C13)c(c4)OC(c(c(OC3)2)ccc(O)c2CC=C(C)C)1)C=C(C)C
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox