Oxostephabenine
[(11R,15S,16S)-14,15-dimethoxy-20-methyl-19-oxo-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-16-yl] benzoate
Also Known As: Oxostephabenine|16-Oxostephabenine|N,O-Dimethyloxostephine benzoate
CAS: 99964-46-2
| Molecular Formula | C27H27NO8 |
|---|---|
| Molecular Weight | 493.17368 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 493.17368 |
| Monoisotopic Mass | 493.17368 |
| Heavy Atoms | 36 |
| Complexity | 939.0 |
Chemical Identifiers
| CAS Number | 99964-46-2 |
|---|---|
| SMILES | CN1C(=O)CC23C14C[C@H](C5=CC6=C(C=C52)OCO6)OC4([C@H]([C@H](C3)OC(=O)C7=CC=CC=C7)OC)OC |
| InChIKey | RENGMXWYDJJRAP-AVUAEGJXSA-N |
Product Overview
Oxostephabenine (CAS 99964-46-2), with molecular formula C27H27NO8 and molecular weight 493.17368 g/mol. IUPAC: [(11R,15S,16S)-14,15-dimethoxy-20-methyl-19-oxo-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-16-yl] benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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