| ID | 1095 |
| Name | Alamarine |
| Pubchem ID | 442157 |
| KEGG ID | C09326 |
| Source | Alangium lamarckii |
| Type | Natural |
| Function | laxative |
| Drug Like Properties | Yes |
| Molecular Weight | 338.36 |
| Exact mass | 338.126657 |
| Molecular formula | C19H18N2O4 |
| XlogP | 1.2 |
| Topological Polar Surface Area | 82.9 |
| H-Bond Donor | 2 |
| H-Bond Acceptor | 5 |
| Rotational Bond Count | 2 |
| IUPAC Name | N/A |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | CC(C1=C2C=C3C4=CC(=C(C=C4CCN3C(=O)C2=CN=C1)OC)O)O |
| Isomeric SMILE | C[C@H](C1=C2C=C3C4=CC(=C(C=C4CCN3C(=O)C2=CN=C1)OC)O)O |
| Drugpedia | wiki |
| References | 1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21 2. Source 3. Function 4. All Records |