HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 39733Generated: November 3, 2026
Ammonium, (5-alpha-androstan-3-beta,17-beta-ylene)bis(dimethyl(2-hydroxyethyl)-, dibromide, diacetate
https://huagongshe.com/en/chemical/39733
Identifiers & Physical Properties
| CAS No. | 50588-19-7 |
|---|
| Molecular formula | C31H56Br2N2O4 |
|---|
| Average molar mass | 680.6 g/mol |
|---|
| Monoisotopic mass | 678.26068 g/mol |
|---|
| SMILES | CC(=O)OCC[N+](C)(C)[C@@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@H]4[N+](C)(C)CCOC(C)=O)[C@@H]3CC[C@H]2C1.[Br-].[Br-] |
|---|
| InChIKey | OMPGSJGRWUKRAF-MKPSAHPLSA-L |
|---|
| PubChem CID | 39733 |
|---|
| DTXSID | DTXSID60964816 |
|---|
Chemical & Physical Properties
| Topological polar surface area | 52.6 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 10 |
|---|
| Heavy atoms | 39 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 856 |
|---|
