Swertiamarin
From Metabolomics.JP
Upper classes
IDs and Links | |
---|---|
LipidBank | [1] |
LipidMaps | [2] |
CAS | 17388-39-5 |
KEGG | {{{KEGG}}} |
KNApSAcK | |
CDX file | |
MOL file | Swertiamarin.mol |
Swertiamarin | |
---|---|
Structural Information | |
Systematic Name | (4aR,5R,6S)-5-Ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-4a-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one |
Common Name |
|
Symbol | |
Formula | C16H22O10 |
Exact Mass | 374.121296924 |
Average Mass | 374.33988 |
SMILES | OCC(C(O)1)OC([H])(OC(O3)C(C=C)C(O)(C2)C(=C3)C(=O)O |
Physicochemical Information | |
Melting Point | |
Boiling Point | |
Density | |
Optical Rotation | |
Reflactive Index | |
Solubility | |
Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |