BRYONIOSIDE D
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 11039571
Name
BRYONIOSIDE D
IUPAC name
(3S,4aS,5aS,6aS,6bS,9R,9aR,11aR,11bS)-9-((2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl)-4,4,6b,9a,11a-pentamethyl-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetradecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-11(2H)-one
SMILES
C[C@H](CC[C@H](C(C)(C)O)O)[C@H]1CC[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2C[C@H]4[C@@]5([C@H]3CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O4)C)C)C
Molecular formula
C36H60O10
Molecular weight
652.87 g/mol
Monoisotopic mass
652.4186 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Bryonia dioica Jacq. | root | - |
Ukiya, M., Akihisa, T., Yasukawa, K., Tokuda, H., Toriumi, M., Koike, K., Kimura, Y., Nikaido, T., Aoi, W., Nishino, H., Takido, M. (2002). Anti-inflammatory and anti-tumor-promoting effects of cucurbitane glycosides from the roots of Bryonia dioica. J Nat Prod, 65(2), 179-183 doi:10.1021/np010423u
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