View source for Mol:BMMCPYTYS603

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 35 37  0  0  1  0  0  0  0  0999 V2000 
    3.7321   -3.7420    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    2.8660   -4.2420    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    2.8660   -5.2420    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    3.7321   -5.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -5.2420    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.4641   -5.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -2.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -3.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -5.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -6.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -4.2420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.4179    4.1059    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    8.4124    4.0013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.0002    4.8104    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    8.5935    5.7239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.5990    5.8284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0112    5.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.8192    3.0878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    9.1813    6.5329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1922    6.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.8301    3.2969    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.8301    3.2969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5211    2.3458    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    6.3301    1.7580    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    6.3301    0.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5701    2.0368    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1391    2.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    0.2580    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -0.7420    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4641   -0.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.4641   -0.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.7420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -2.2420    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0981   -1.3760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0981   -3.1080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  5 11  1  0  0  0  0 
  5  4  1  0  0  0  0 
  4  3  1  0  0  0  0 
  3  2  1  0  0  0  0 
  2  1  1  0  0  0  0 
  1 11  1  0  0  0  0 
  5  6  1  6  0  0  0 
  1  7  1  4  0  0  0 
  3  9  1  6  0  0  0 
  2  8  1  1  0  0  0 
  4 10  2  0  0  0  0 
 22 21  1  0  0  0  0 
 21 27  1  6  0  0  0 
 24 27  1  6  0  0  0 
 24 23  1  0  0  0  0 
 23 22  1  0  0  0  0 
 24 25  1  0  0  0  0 
 21 12  1  0  0  0  0 
 25 28  1  0  0  0  0 
 28 29  1  0  0  0  0 
 29 32  1  0  0  0  0 
 29 31  1  0  0  0  0 
 29 30  2  0  0  0  0 
 32 33  1  0  0  0  0 
 33  7  1  0  0  0  0 
 33 35  1  0  0  0  0 
 33 34  2  0  0  0  0 
 23 26  1  1  0  0  0 
 14 15  1  0  0  0  0 
 14 13  1  0  0  0  0 
 13 12  1  0  0  0  0 
 12 17  1  0  0  0  0 
 17 16  2  0  0  0  0 
 16 15  1  0  0  0  0 
 13 18  2  0  0  0  0 
 15 19  2  0  0  0  0 
 16 20  1  0  0  0  0 
S  SKP  7 
ID	BMMCPYTYS603 
NAME	dTDP-4-dehydro-6-deoxy-D-galactose 
FORMULA	C16H24N2O15P2 
EXACTMASS	546.0651 
AVERAGEMASS	546.3137 
SMILES	O=C(N3)C(C)=CN(C(=O)3)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(=O)OC(O2)[C@H](O)[C@@H](O)C(=O)[C@@H](C)2)[C@@H](O)1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04269 
M  END