POLYGALAXANTHONE VII
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 162921533
Name
POLYGALAXANTHONE VII
IUPAC name
3-(((2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-1,6-dihydroxy-2,7-dimethoxy-9H-xanthen-9-one
SMILES
O=C1C(C=C(OC)C(O)=C2)=C2OC3=C1C(O)=C(OC)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5[C@@H](O)[C@@H](O)[C@H](O)[C@@H](C)O5)=C3
Molecular formula
C27H32O16
Molecular weight
612.54 g/mol
Monoisotopic mass
612.1690 Da
Pathway:
Superclass:
Class:
Glycoside:
Yes
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
|