Mol:BMCCPUGU0010

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Copyright: ARM project http://www.metabolome.jp/
 31 33  0  0  1  0  0  0  0  0999 V2000
    3.7321    4.5966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    4.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    3.0966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    2.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    3.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    4.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1229    2.4275    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5296    1.5140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5241    1.6185    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    4.5966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    4.5966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1933    0.8753    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9854   -0.1028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8514   -0.6028    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5945    0.0663    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.5727   -0.1416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9559   -1.5973    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1878    0.9799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8817   -1.0926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8598   -1.3006    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    7.6519   -2.2787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0678   -0.3224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8380   -1.5085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1470   -2.4595    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    8.1959   -2.7685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0981   -2.1505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4560   -3.4106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4342   -3.6185    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   10.2263   -4.5966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6421   -2.6403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4123   -3.8264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 24 26  2  0  0  0  0
 20 23  1  0  0  0  0
 24 27  1  0  0  0  0
 27 28  1  0  0  0  0
 19 20  1  0  0  0  0
 23 24  1  0  0  0  0
 28 31  2  0  0  0  0
 28 29  1  0  0  0  0
 20 22  2  0  0  0  0
 28 30  1  0  0  0  0
 24 25  1  0  0  0  0
 20 21  1  0  0  0  0
  5  6  1  0  0  0  0
  3  2  2  0  0  0  0
 14 17  1  1  0  0  0
  6  1  1  0  0  0  0
  6 11  2  0  0  0  0
  5  7  1  0  0  0  0
 14 15  1  0  0  0  0
  2  1  1  0  0  0  0
 12  9  1  0  0  0  0
  9  4  1  0  0  0  0
  9  8  1  0  0  0  0
 12 13  1  0  0  0  0
 12 18  1  6  0  0  0
  4  5  2  0  0  0  0
  4  3  1  0  0  0  0
  8  7  2  0  0  0  0
 13 14  1  0  0  0  0
 15 18  1  6  0  0  0
 15 16  1  0  0  0  0
  2 10  1  0  0  0  0
 16 19  1  0  0  0  0
S  SKP  7
ID	BMCCPUGU0010
NAME	dGTP
FORMULA	C10H16N5O13P3
EXACTMASS	506.9957
AVERAGEMASS	507.1812
SMILES	NC(N3)=Nc(c2C(=O)3)n(cn2)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C00286
M  END

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