| ID | 2768 |
| Name | Neuro_000455 |
| Pubchem ID | 633058 |
| KEGG ID | N/A |
| Source | N/A |
| Type | Unknown |
| Function | Unknown |
| Drug Like Properties | Yes |
| Molecular Weight | 374.45 |
| Exact mass | 374.118795 |
| Molecular formula | C20H22O5S |
| XlogP | 1.8 |
| Topological Polar Surface Area | 65 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 5 |
| Rotational Bond Count | 4 |
| IUPAC Name | 7-hydroxy-1,2,3-trimethoxy-10-methylsulfanyl-6,7-dihydro-5H-benzo[g]heptalen-9-one |
| Structure | |
| SDF file | |
| MOL file | |
| PDB file | |
| Canonical SMILE | COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)SC)O)OC)OC |
| Isomeric SMILE | N/A |
| Drugpedia | wiki |
| References | 1. Source 2. Function 3. All Records |