CUCURBITACIN R
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 44448367
Name
CUCURBITACIN R
IUPAC name
(2S,8S,9R,10R,13R,14S,16R,17R)-17-((S)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-1,4,7,8,9,10,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthrene-3,11(2H)-dione
SMILES
C[C@@]12C[C@H]([C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)C)C)[C@@](C)(C(=O)CCC(C)(C)O)O)O
Molecular formula
C30H46O7
Molecular weight
518.69 g/mol
Monoisotopic mass
518.3244 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Lysimachia arvensis (L.) U.Manns & Anderb. | - | - |
Yamada, Y., Hagiwara, K., Iguchi, K., Takahashi, Y., Suzuki, S. (1978). Carbon-13 nmr spectral assignments of cucurbitacin aglycones. Chem Lett, 319 doi:10.1246/cl.1978.319
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