BMFYS8ESa002
From Metabolomics.JP
(Difference between revisions)
| Line 2: | Line 2: | ||
|SysName=3-Oxo-octanoyl-CoA | |SysName=3-Oxo-octanoyl-CoA | ||
|Common Name=&&3-Oxooctanoyl-CoA&& | |Common Name=&&3-Oxooctanoyl-CoA&& | ||
| − | |CAS= | + | |CAS=54684-64-9 |
|KEGG=C05267 | |KEGG=C05267 | ||
}} | }} | ||
Revision as of 09:00, 14 July 2008
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 54684-64-9 |
| KEGG | C05267 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMFYS8ESa002.mol |
| 3-Oxooctanoyl-CoA | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3-Oxo-octanoyl-CoA |
| Common Name |
|
| Symbol | |
| Formula | C29H48N7O18P3S |
| Exact Mass | 907.1989 |
| Average Mass | 907.715 |
| SMILES | C(C([C@H](C(=O)NCCC(NCCSC(=O)CC(CCCCC)=O)=O)O)(C)C |
| 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
