POKEBERRYGENIN
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 156580
Name
POKEBERRYGENIN
IUPAC name
(2R,4aR,6aS,6bR,10R,11S,12aR,12bR,14bR)-10,11-dihydroxy-2-(methoxycarbonyl)-2,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
SMILES
C[C@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CCC5[C@@]4(C[C@@H]([C@@H](C5(C)C)O)O)C)C)[C@H]2C1)C)C(=O)O)C(=O)OC
Molecular formula
C31H48O6
Molecular weight
516.72 g/mol
Monoisotopic mass
516.3451 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Phytolacca americana L. | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|