BMMCBZ2Pa012
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| + | {{Hierarchy|{{PAGENAME}}}} | ||
| + | |||
{{Metabolite | {{Metabolite | ||
|SysName=4-Chloro-benzoyl-CoA | |SysName=4-Chloro-benzoyl-CoA | ||
Revision as of 09:00, 1 October 2008
| 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 : BMMC mono- or assembled cycle 単、複合環 : BMMCBZ benzene ring ベンゼン環 : BMMCBZ2P with 2 substitutions (para) (64 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 117380-98-0 |
| KEGG | C06387 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCBZ2Pa012.mol |
| |
| Structural Information | |
| Systematic Name | 4-Chloro-benzoyl-CoA |
| Common Name | |
| Symbol | |
| Formula | C28H39ClN7O17P3S |
| Exact Mass | 905.1024 |
| Average Mass | 906.0862 |
| SMILES | c(Cl)(c1)ccc(C(SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP( |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
Related Atomic Mappings, Enzymes, and Pathways
