Mol:BMSUM5Ke--01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 1 0 0 0 0 0999 V2000
3.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 1.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.8660 0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -1.7500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 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 0 0 0 0
2 6 2 0 0 0 0
3 7 1 1 0 0 0
4 8 1 1 0 0 0
5 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
10 12 2 0 0 0 0
10 13 1 0 0 0 0
S SKP 7
ID BMSUM5Ke--01
NAME 1-Deoxy-D-xylulose 5-phosphate
FORMULA C5H11O7P
EXACTMASS 214.0242
AVERAGEMASS 214.1104
SMILES CC(=O)[C@@H](O)[C@H](O)COP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11437
M END
