FL63ACNS0009
From Metabolomics.JP
| Flavonoid Top | Molecule Index | Author Index | Journals | Structure Search | Food | New Input |
Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol : FL63AC Catechin and Epicatechin (75 pages) : FL63ACNS Simple substitution (24 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 83104-86-3 |
| KEGG | {{{KEGG}}} |
| KNApSAcK | |
| CDX file | |
| MOL file | FL63ACNS0009.mol |
| Epicatechin 3-O- (3-O-methylgallate) | |
|---|---|
| |
| Structural Information | |
| Systematic Name | (2R) -3,4-Dihydro-2alpha- (3,4-dihydroxyphenyl) -2H-1-benzopyran-3alpha,5,7-triol 3- (3,4-dihydroxy-5-methoxybenzoate) |
| Common Name |
|
| Symbol | |
| Formula | C23H20O10 |
| Exact Mass | 456.10564686 |
| Average Mass | 456.3989 |
| SMILES | c(c1)(O)cc(O2)c(CC(OC(c(c4)cc(OC)c(c(O)4)O)=O)C2c( |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
Species Information
| Species-Flavonoid Relationship Reported | ||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
|
