| ID | 2753 |
| Name | NCGC00180968-01 |
| Pubchem ID | 24871298 |
| KEGG ID | N/A |
| Source | N/A |
| Type | Unknown |
| Function | Unknown |
| Drug Like Properties | No |
| Molecular Weight | 699.66 |
| Exact mass | 698.252557 |
| Molecular formula | C37H44Cl2N2O7 |
| XlogP | N/A |
| Topological Polar Surface Area | 81.6 |
| H-Bond Donor | 4 |
| H-Bond Acceptor | 9 |
| Rotational Bond Count | 2 |
| IUPAC Name | N/A |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | CN1CCC2=CC(=C3C=C2C1CC4=CC(=CC=C4)OC5=C6C(CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.Cl.[Cl-] |
| Isomeric SMILE | CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC(=CC=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC.O.Cl.[Cl-] |
| Drugpedia | wiki |
| References | 1. Source 2. Function 3. All Records |