Mol:BMSUM5Ke--05
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
14 13 0 0 1 0 0 0 0 0999 V2000
5.4641 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 -0.0670 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7321 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -1.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 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 0 0 0 0
5 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
11 13 1 0 0 0 0
11 14 2 0 0 0 0
3 8 1 6 0 0 0
4 9 1 6 0 0 0
2 7 2 0 0 0 0
S SKP 7
ID BMSUM5Ke--05
NAME D-Xylulose 5-phosphate
FORMULA C5H11O8P
EXACTMASS 230.0191
AVERAGEMASS 230.1098
SMILES OCC(=O)[C@@H](O)[C@H](O)COP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00231
M END
