Mol:BMSUM4Ae--02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
12 11 0 0 1 0 0 0 0 0999 V2000
5.4641 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.1830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 0.1830 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7321 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.8170 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 5 2 0 0 0 0
2 6 1 6 0 0 0
2 3 1 0 0 0 0
3 7 1 6 0 0 0
3 4 1 0 0 0 0
4 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
9 11 1 0 0 0 0
9 12 2 0 0 0 0
S SKP 7
ID BMSUM4Ae--02
NAME D-Threose 4-phosphate
FORMULA C4H9O7P
EXACTMASS 200.0085
AVERAGEMASS 200.0838
SMILES O=C[C@@H](O)[C@H](O)COP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03109
M END
