Mol:BMFYB4PHr001
From Metabolomics.JP
(Difference between revisions)
(One intermediate revision by one user not shown) | |||
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 15 14 0 0 0 0 0 0 0 0999 V2000 | + | 15 14 0 0 0 0 0 0 0 0999 V2000 |
− | 6.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7321 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7321 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.4641 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4641 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7321 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7321 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.8660 -1.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8660 -1.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.3660 -1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3660 -1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3660 -0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0000 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0000 -2.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -2.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0000 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
− | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
− | 2 5 1 0 0 0 0 | + | 2 5 1 0 0 0 0 |
− | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
− | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
− | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
− | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
− | 12 14 1 0 0 0 0 | + | 12 14 1 0 0 0 0 |
− | 12 15 2 0 0 0 0 | + | 12 15 2 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMFYB4PHr001 | + | ID BMFYB4PHr001 |
− | NAME | + | NAME [(E) - 4-Hydroxy-3-methylbut-2-enyl] phosphono hydrogen phosphate |
− | FORMULA C5H12O8P2 | + | CAS_RN 396726-03-7 |
− | EXACTMASS 262.0007 | + | FORMULA C5H12O8P2 |
− | AVERAGEMASS 262.0915 | + | EXACTMASS 262.0007 |
− | SMILES OCC(C)=CCOP(O)(=O)OP(O)(O)=O | + | AVERAGEMASS 262.0915 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11811 | + | SMILES OCC(C)=CCOP(O)(=O)OP(O)(O)=O |
+ | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11811 | ||
M END | M END | ||
− |
Latest revision as of 17:37, 16 June 2010
Copyright: ARM project http://www.metabolome.jp/ 15 14 0 0 0 0 0 0 0 0999 V2000 6.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.0000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.5000 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 1 6 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 8 10 1 0 0 0 0 8 9 2 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 S SKP 7 ID BMFYB4PHr001 NAME [(E) - 4-Hydroxy-3-methylbut-2-enyl] phosphono hydrogen phosphate CAS_RN 396726-03-7 FORMULA C5H12O8P2 EXACTMASS 262.0007 AVERAGEMASS 262.0915 SMILES OCC(C)=CCOP(O)(=O)OP(O)(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11811 M END