SIMIARENONE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 12442794
Name
SIMIARENONE
IUPAC name
(3R,3aR,5aR,5bS,9S,11aS,11bR,13aS,13bR)-3-isopropyl-3a,5a,8,8,11b,13a-hexamethyl-2,3,3a,4,5,5a,5b,6,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-ol
SMILES
CC(C)[C@H]1CC[C@@H]2[C@@]1(CC[C@]3([C@]2(CC[C@@]4([C@@H]3CC=C5[C@H]4CC[C@@H](C5(C)C)O)C)C)C)C
Molecular formula
C30H50O
Molecular weight
426.73 g/mol
Monoisotopic mass
426.3862 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Euphorbia peplus L. | - | - |
Ferreira, M.J.U., Lobo, A.M., Wyler, H. (1993). Triterpenoids and steroids from Euphorbia peplus. Fitoterapia, 64(1), 85-87
|