Sibiricose A1
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6326016
Name
Sibiricose A1
IUPAC name
((2R,3S,4S,5R,6R)-6-(((2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylate
SMILES
COC1=C(O)C(OC)=CC(/C=C/C(OC[C@@H]2[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O[C@@]3(CO)[C@@H](O)[C@H](O)[C@@H](CO)O3)O2)=O)=C1
Molecular formula
C23H32O15
Molecular weight
548.49 g/mol
Monoisotopic mass
548.1741 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Polygala major Jacq. | - | - |
Comprehensive characterization of in vivo metabolic profile of Polygalae radix based on ultra-high-performance liquid chromatography tandem mass spectrometry (SI) doi:10.1016/j.jpba.2018.12.005
|