BMMCAS--k017
From Metabolomics.JP
| 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 : BMMCAS assembled 複合環 (15 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 928005-90-7 |
| KEGG | C02572 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCAS--k017.mol |
| O-Feruloylquinate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | O-Feruloyl-quinic acid |
| Common Name |
|
| Symbol | |
| Formula | C17H20O9 |
| Exact Mass | 368.1107 |
| Average Mass | 368.3352 |
| SMILES | COc(c1)c(O)ccc(C=CC(=O)O[C@H](C2)[C@H](O)[C@H](O)C |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
