HuagongsheHuagongshe Chemistry Print Report · For research reference only
Octyl 2-O-(mannopyranosyl-6-phosphate)mannopyranoside
octyl 2-O-(mannopyranosyl-6-phosphate)mannopyranoside
Identifiers & Physical Properties
| CAS No. | 157758-69-5 |
|---|---|
| Molecular formula | C20H37Na2O14P |
| Average molar mass | 578.5 g/mol |
| Monoisotopic mass | 578.17163141 g/mol |
| SMILES | CCCCCCCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H](O)[C@@H]1O.[Na+].[Na+] |
| InChIKey | LYZXIKNZJGBZJC-GDSMGQCOSA-L |
| PubChem CID | 190889 |
| DTXSID | DTXSID90935796 |
Chemical & Physical Properties
| Topological polar surface area | 231 |
|---|---|
| Hydrogen bond donors | 6 |
| Hydrogen bond acceptors | 14 |
| Rotatable bonds | 13 |
| Heavy atoms | 37 |
| Formal charge | 0 |
| Complexity | 638 |