| ID | 2747 |
| Name | Narcotoline |
| Pubchem ID | 442330 |
| KEGG ID | C09593 |
| Source | Papaver somniferum |
| Type | Natural |
| Function | Respiratory stimulant |
| Drug Like Properties | Yes |
| Molecular Weight | 399.39 |
| Exact mass | 399.131802 |
| Molecular formula | C21H21NO7 |
| XlogP | 2.4 |
| Topological Polar Surface Area | 86.7 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 8 |
| Rotational Bond Count | 3 |
| IUPAC Name | (3S)-3-[(5R)-4-hydroxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6,7-dimethoxy-3H-2-benzofuran-1-one |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | CN1CCC2=CC3=C(C(=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)O)OCO3 |
| Isomeric SMILE | CN1CCC2=CC3=C(C(=C2[C@@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)O)OCO3 |
| Drugpedia | wiki |
| References | 1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21 2. Source 3. Function 4. All Records |