BMAXS3AKa002
From Metabolomics.JP
(Difference between revisions)
| (6 intermediate revisions by one user not shown) | |||
| Line 1: | Line 1: | ||
| + | {{Hierarchy|{{PAGENAME}}}} | ||
| + | |||
{{Metabolite | {{Metabolite | ||
| − | |SysName= | + | |SysName=S- [2- [3- [ [4- [ [ [(2R,3S,4R,5R) -5- (6-Aminopurin-9-yl) -4-hydroxy-3-phosphonooxyoxolan-2-yl] methoxy-hydroxyphosphoryl] oxy-hydroxyphosphoryl] oxy-2-hydroxy-3,3- dimethylbutanoyl] amino] propanoylamino] ethyl] 3-aminopropanethioic acid |
|Common Name=&&beta-Alanyl-CoA&& | |Common Name=&&beta-Alanyl-CoA&& | ||
| − | |CAS= | + | |CAS=6875-55-4 |
|KEGG=C02335 | |KEGG=C02335 | ||
}} | }} | ||
Latest revision as of 11:49, 16 June 2010
| Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMAX Amino acid derivatives アミノ酸誘導体 : BMAXS straight chain 鎖状 (83 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 6875-55-4 |
| KEGG | C02335 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMAXS3AKa002.mol |
| beta-Alanyl-CoA | |
|---|---|
| |
| Structural Information | |
| Systematic Name | S- [2- [3- [ [4- [ [ [(2R,3S,4R,5R) -5- (6-Aminopurin-9-yl) -4-hydroxy-3-phosphonooxyoxolan-2-yl] methoxy-hydroxyphosphoryl] oxy-hydroxyphosphoryl] oxy-2-hydroxy-3,3- dimethylbutanoyl] amino] propanoylamino] ethyl] 3-aminopropanethioic acid |
| Common Name |
|
| Symbol | |
| Formula | C24H41N8O17P3S |
| Exact Mass | 838.1523 |
| Average Mass | 838.6133 |
| SMILES | n(c3N)cnc(c32)n(cn2)[C@@H]([C@@H]1O)O[C@@H]([C@H]1 |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
