Mol:BMMCPYURS503

From Metabolomics.JP
Jump to: navigation, search

BMMCPYURS503.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 35  0  0  1  0  0  0  0  0999 V2000 
   12.0674    4.4035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.1720    3.4090    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
   11.2584    3.0022    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
   10.5893    3.7454    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    9.5948    3.8499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.0380    2.9090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   11.0505    2.0241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   11.0893    4.6114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    9.0070    3.0409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7601   -1.6114    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8940   -2.1114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8940   -3.1114    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7601   -3.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6261   -3.1114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6261   -2.1114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0280   -1.6114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7601   -4.6114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7601   -0.6114    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    2.9511   -0.0236    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    3.2601    0.9274    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    4.2601    0.9274    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    4.8479    1.7364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -0.3326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6723    1.7364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5691   -0.0236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.8424    1.6319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.4302    2.4409    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    7.2392    1.8532    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.6211    3.0287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0180    3.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0125    3.1454    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    7.9079    2.1509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.1170    4.1399    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 21 20  1  0  0  0  0 
 20 19  1  0  0  0  0 
 19 18  1  0  0  0  0 
 18 25  1  1  0  0  0 
 21 25  1  1  0  0  0 
 18 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 10  1  0  0  0  0 
 13 17  2  0  0  0  0 
 11 16  2  0  0  0  0 
 19 23  1  6  0  0  0 
 20 24  1  6  0  0  0 
 21 22  1  0  0  0  0 
 22 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 30  1  0  0  0  0 
 30 31  1  0  0  0  0 
 27 29  2  0  0  0  0 
 27 28  1  0  0  0  0 
 31 32  2  0  0  0  0 
 31 33  1  0  0  0  0 
 31  9  1  0  0  0  0 
  9  5  1  0  0  0  0 
  4  8  1  0  0  0  0 
  8  1  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 
  4  5  1  4  0  0  0 
  3  7  1  6  0  0  0 
  2  6  1  1  0  0  0 
S  SKP  6 
ID	BMMCPYURS503 
NAME	UDP-D-xylulose 
FORMULA	C14H22N2O15P2 
EXACTMASS	520.0495 
AVERAGEMASS	520.2764 
SMILES	O=C(C=3)NC(=O)N(C3)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OCC(O2)[C@@H](O)[C@H](O)C2)1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox