| ID | 2822 |
| Name | NSC169687 |
| Pubchem ID | 5458375 |
| KEGG ID | N/A |
| Source | N/A |
| Type | Unknown |
| Function | Unknown |
| Drug Like Properties | No |
| Molecular Weight | 443.47 |
| Exact mass | 443.103873 |
| Molecular formula | C22H21NO7S |
| XlogP | N/A |
| Topological Polar Surface Area | 117 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 7 |
| Rotational Bond Count | 3 |
| IUPAC Name | 10,11-dimethoxy-8-methylisoquinolino[3,2-a]isoquinolin-7-ium;2-sulfoacetate |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC=CC=C43)OC)OC.C(C(=O)[O-])S(=O)(=O)O |
| Isomeric SMILE | N/A |
| Drugpedia | wiki |
| References | 1. Source 2. Function 3. All Records |