INGENOL-3-O-ANGELATE,20-DEOXY
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 9844698
Name
INGENOL-3-O-ANGELATE,20-DEOXY
IUPAC name
(1aR,2S,5R,5aS,6S,8aS,9R,10aR)-5,5a-dihydroxy-1,1,4,7,9-pentamethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-6-yl (Z)-2-methylbut-2-enoate
SMILES
C(=C(\C)C(=O)O[C@H]1C(=C[C@@]24[C@@]1([C@@H](C(=C[C@H](C2=O)[C@H]3[C@H](C3(C)C)C[C@H]4C)C)O)O)C)(/C)[H]
Molecular formula
C25H34O5
Molecular weight
414.54 g/mol
Monoisotopic mass
414.2406 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Euphorbia peplus L. | - | - |
Hohmann, J., Evanics, F., Berta, L., Bartok, T. (2000). Diterpenoids from Euphorbia peplus. Planta Med, 66(3), 291-294 doi:10.1055/s-2000-8568
|
| Euphorbia peplus L. | - | - |
Jakupovic, J., Morgenstern, T., Bittner, M., Silva, M. (1998). Diterpenes from Euphorbia peplus. Phytochemistry, 47(8), 1601-1609 doi:10.1016/s0031-9422(97)00831-5
|