HuagongsheHuagongshe Chemistry Print Report · For research reference only
Nematocyphol
nematocyphol

Identifiers & Physical Properties
| CAS No. | 143490-50-0 |
|---|---|
| Molecular formula | C30H50O |
| Average molar mass | 426.7 g/mol |
| Monoisotopic mass | 426.38616621 g/mol |
| SMILES | CC(C)[C@H]1CC[C@]2(C)CC[C@]3(C)C4=CC[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]12 |
| InChIKey | QOYZWNYLMKAORW-XKIBWVOHSA-N |
| PubChem CID | 3083379 |
| DTXSID | DTXSID20931903 |
Chemical & Physical Properties
| XLogP | 9 |
|---|---|
| Topological polar surface area | 20.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 1 |
| Heavy atoms | 31 |
| Formal charge | 0 |
| Complexity | 777 |
Applications & Uses
Description
Nematocyphol is triterpene constituents from Euphorbia nematocypha Hand-Mazz. Seven triterpenoids have been isolated from the roots of Euphorbia nematocypha Hand-Mazz. through chromatography on 20% AgNO3-silica gel. One of them was identified as a new compound named nematocyphol on the basis of spectral data (IR, EIMS, 1H-NMR and 13C-NMR). Its structure was deduced as IVa. Other compounds were identified as nepehinol acetate (I), germanicol acetate (II), euphol (III), tanaxastanol (Va), 24-methylenecycloartanol (VIa) and nepehinol (VIIa). These compounds were obtained for the first time from this plant.