Mol:FL2FALNP0006

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

FL2FALNP0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 34  0  0  0  0  0  0  0  0999 V2000 
   -1.3846   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3846   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8283   -1.2845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2720   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2720   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8283    0.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2844   -1.2845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8407   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8407   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2844    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3967    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9637   -0.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5307    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5307    0.6548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9637    0.9821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3967    0.6548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2844   -1.8283    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8283   -1.9266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0975    0.9821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8283    0.6424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3843    0.9634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3843    1.6055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9404    1.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8283    1.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8299    0.9821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9409    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4972   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4972   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9409   -1.2845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0333   -0.0114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0975   -0.4818    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 
  9 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  2  0  0  0  0 
  3 18  1  0  0  0  0 
 14 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 
 16 25  1  0  0  0  0 
  1 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 29  2  0  0  0  0 
 29  2  1  0  0  0  0 
 27 30  1  0  0  0  0 
 27 31  1  0  0  0  0 
S  SKP  8 
ID	FL2FALNP0006 
KNApSAcK_ID	C00008359 
NAME	Flemichin D 
CAS_RN	57096-07-8 
FORMULA	C25H26O6 
EXACTMASS	422.172938564 
AVERAGEMASS	422.47033999999996 
SMILES	c(O3)(c(C(CC(c(c4)c(O)cc(O)c4)3)=O)2)c(CC=C(C)C)c(O1)c(c2O)C=CC1(C)C 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox