Mol:BMCCPUXA0022

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BMCCPUXA0022.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 20 22  0  0  1  0  0  0  0  0999 V2000 
    3.7321    3.0970    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    2.5970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.5970    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.0970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.5970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    2.5970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1229    0.9279    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5296    0.0143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5241    0.1188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    3.0970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    3.0970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1933   -0.6243    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    3.9854   -1.6025    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    4.8514   -2.1025    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.5945   -1.4333    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    6.5727   -1.6412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0718   -2.0092    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.9559   -3.0970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1878   -0.5198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.2418   -0.8981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 15 19  1  6  0  0  0 
 15 14  1  0  0  0  0 
 12 19  1  6  0  0  0 
 14 13  1  0  0  0  0 
 12 13  1  0  0  0  0 
 12  9  1  0  0  0  0 
 13 17  1  1  0  0  0 
 14 18  1  1  0  0  0 
 15 16  1  0  0  0  0 
 16 20  1  0  0  0  0 
  1  6  1  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  5  6  1  0  0  0  0 
  5  4  2  0  0  0  0 
  4  9  1  0  0  0  0 
  9  8  1  0  0  0  0 
  8  7  2  0  0  0  0 
  7  5  1  0  0  0  0 
  6 11  2  0  0  0  0 
  2 10  2  0  0  0  0 
S  SKP  7 
ID	BMCCPUXA0022 
NAME	Xanthosine 
FORMULA	C10H12N4O6 
EXACTMASS	284.0756 
AVERAGEMASS	284.2256 
SMILES	OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(N2)c(n3)C(=O)NC(=O)2 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01762 
M  END
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