Mol:FL1C29NP0001

From Metabolomics.JP
Jump to: navigation, search

FL1C29NP0001.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
    2.0245    0.3194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0245   -0.3230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5808   -0.6441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1371   -0.3230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1371    0.3194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5808    0.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7675   -0.3230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3238   -0.6441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2114   -0.6440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3495   -0.3104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2114   -1.2848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3495    0.3277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9022    0.6468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4548    0.3277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4548   -0.3104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9022   -0.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9022   -1.2676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0074    0.6468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5601    0.3277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5601   -0.3104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0074   -0.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9965    0.7642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1371    0.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9022    1.2848    0.0000 O   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 
  7  8  2  0  0  0  0 
  7  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
  9 11  2  0  0  0  0 
  2  8  1  0  0  0  0 
 10 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 10  1  0  0  0  0 
 17 16  1  0  0  0  0 
 14 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  2  0  0  0  0 
 21 15  1  0  0  0  0 
 19 22  1  0  0  0  0 
 19 23  1  0  0  0  0 
 13 24  1  0  0  0  0 
S  SKP  8 
ID	FL1C29NP0001 
KNApSAcK_ID	C00007077 
NAME	Flemichapparin A 
CAS_RN	32507-61-2,30880-56-9 
FORMULA	C20H18O4 
EXACTMASS	322.120509064 
AVERAGEMASS	322.35452 
SMILES	c(c3)ccc(c3)C=CC(c(c(O)2)cc(O)c(c21)OC(C=C1)(C)C)=O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox