TENUIFOLIOSE A
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Name
TENUIFOLIOSE A
IUPAC name
(2S,3R,4R,5S)-2-(((2R,3S,4S,5R,6S)-4-(((2R,3R,4S,5S,6S)-5-acetoxy-6-(acetoxymethyl)-3-hydroxy-4-(((2S,3S,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-(acetoxymethyl)-5-(((E)-3-(4-hydroxy-3-methoxyphenyl)acryloyl)oxy)-3-(((2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-5-(hydroxymethyl)-2-((((E)-3-(4-hydroxyphenyl)acryloyl)oxy)methyl)tetrahydrofuran-3-yl benzoate
SMILES
[C@H]1([C@@H](O[C@@H]([C@H]([C@H]1O[C@H]2O[C@H]([C@@H]([C@H]([C@H]2O)O[C@H]3[C@H]([C@@H]([C@H]([C@H](O3)CO)O)O)O)OC(=O)C)COC(=O)C)O[C@@H]4O[C@H]([C@H]([C@@H]([C@H]4O)O)O)CO)O[C@@]5(O[C@H]([C@H]([C@H]5OC(=O)C6=CC=CC=C6)O)CO)COC(=O)/C=C/C7=CC=C(C=C7)O)COC(=O)C)OC(=O)/C=C/C8=CC(=C(C=C8)O)OC
Molecular formula
C62H76O35
Molecular weight
1,381.26 g/mol
Monoisotopic mass
1,380.4167 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
|