BRYDIOSIDE A
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 101625614
Name
BRYDIOSIDE A
IUPAC name
(2S,8S,9R,10R,13R,14S,17S)-17-((R)-2-hydroxy-6-methyl-3-oxo-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)heptan-2-yl)-4,4,9,13,14-pentamethyl-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4,7,8,9,10,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione
SMILES
C[C@@]12CC[C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)[C@](C)(C(=O)CCC(C)(C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O
Molecular formula
C42H66O16
Molecular weight
826.97 g/mol
Monoisotopic mass
826.4351 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Bryonia dioica Jacq. | root | - |
Oobayashi, K., Yoshikawa, K., Arihara, S. (1992). Structural revision of bryonoside and structure elucidation of minor saponins from Bryonia dioica. Phytochemistry, 31(3), 943-946 doi:10.1016/0031-9422(92)80044-f
|