Mol:BMMCPYXXe004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
18 18 0 0 0 0 0 0 0 0999 V2000
7.3301 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.3301 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 0.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -0.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3660 1.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 2.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 1 1 0 0 0 0
6 5 2 0 0 0 0
5 4 1 0 0 0 0
4 3 2 0 0 0 0
3 2 1 0 0 0 0
2 1 2 0 0 0 0
2 7 1 0 0 0 0
4 8 1 0 0 0 0
5 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
11 14 1 0 0 0 0
11 12 1 0 0 0 0
11 13 2 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
15 17 1 0 0 0 0
15 18 2 0 0 0 0
S SKP 7
ID BMMCPYXXe004
NAME (4-Amino-2-methylpyrimidin-5-yl) methyl phosphono hydrogen phosphate
CAS_RN 841-01-0
FORMULA C6H11N3O7P2
EXACTMASS 299.0072
AVERAGEMASS 299.115
SMILES Cc(n1)nc(N)c(c1)COP(O)(=O)OP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C04752
M END
