Mol:BMSUM7Ke--01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 21 0 0 1 0 0 0 0 0999 V2000
6.4641 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 0.8170 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.7321 0.3170 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.7321 -0.6830 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.8660 -1.1830 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.8660 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 3.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3301 3.8170 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
7.8301 2.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 4.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8301 4.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 2.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -1.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -3.6830 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 -3.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -4.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.6830 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
2 13 2 0 0 0 0
3 14 1 1 0 0 0
4 5 1 0 0 0 0
4 15 1 1 0 0 0
5 16 1 6 0 0 0
5 6 1 0 0 0 0
6 17 1 1 0 0 0
6 7 1 0 0 0 0
7 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
19 22 1 0 0 0 0
19 21 2 0 0 0 0
1 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
9 12 2 0 0 0 0
9 11 1 0 0 0 0
S SKP 7
ID BMSUM7Ke--01
NAME D-Sedoheptulose 1,7-bisphosphate
FORMULA C7H16O13P2
EXACTMASS 370.0066
AVERAGEMASS 370.1416
SMILES O[C@H](COP(O)(O)=O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)COP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00447
M END
