| Compound | (7S,8S,7'S,8'S)-3,3',4'-trihydroxy-4-methoxy-7,7'-epoxylignan |
| NPACT-Id | NPACT01420 |
| IUPAC | 4-[(2S,3S,4S,5S)-5-(3-hydroxy-4-methoxyphenyl)-3,4-dimethyloxolan-2-yl]benzene-1,2-diol |
| Synonyms | - |
| PubChem Id | 11336474 |
| Class | Lignans |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | XEYABMSDSCEFHX-GTXVLXIYSA-N |
| InChi | 1S/C19H22O5/c1-10-11(2)19(13-5-7-17(23-3)16(22)9-13)24-18(10)12-4-6-14(20)15(21)8-12/h4-11,18-22H,1-3H3/t10-,11-,18-,19-/m0/s1 |
| SMILES | O1[C@@H]([C@H]([C@@H]([C@H]1c1cc(O)c(O)cc1)C)C)c1cc(O)c(OC)cc1 |
|
SMART | [#6]OC1=C(O)C=C(C=C1)[C@H]1O[C@@H]([C@@H]([#6])[C@@H]1[#6])C1=CC(O)=C(O)C=C1 |
| CAS No. | - |
|
Structure
Download | 
|
| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |