| Compound | [3]-dehydroparadol |
| NPACT-Id | NPACT01056 |
| IUPAC | - |
| Synonyms | 1-Decen-3-one, 1-(4-hydroxy-3-methoxyphenyl)-;(E)-1-(4-hydroxy-3-methoxyphenyl)dec-1-en-3-one; |
| PubChem Id | 6438480 |
| Class | Organic chemical |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | AXMBOMODZLJDKX-PKNBQFBNSA-N |
| InChi | 1S/C17H24O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h9-13,19H,3-8H2,1-2H3/b11-9+ |
| SMILES | O=C(CCCCCCC)/C=C/c1cc(OC)c(O)cc1 |
|
SMART | [H]OC1=C(OC([H])([H])[H])C([H])=C(C([H])=C(/[H])C(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])=C1[H] |
| CAS No. | 53172-10-4 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C088509 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, |
| 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 |