| Compound | Geranyl acetone |
| NPACT-Id | NPACT00609 |
| IUPAC | (5E)-6,10-dimethylundeca-5,9-dien-2-one |
| Synonyms | Dihydropseudoionone; trans-Geranylacetone; Geranyl-2-propanone |
| PubChem Id | 1549778 |
| Class | Terpenoids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | HNZUNIKWNYHEJJ-FMIVXFBMSA-N |
| InChi | 1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+ |
| SMILES | O=C(CC/C=C(/CCC=C(C)C)C)C |
|
SMART | [H]C(=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C(=C(/[H])C([H])([H])C([H])([H])C(=O)C([H])([H])[H])C([H])([H])[H] |
| CAS No. | 689-67-8 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, AKos Consulting & Solutions, Amadis Chemical, Ambinter, Angene International, ChemExper Chemical Directory, ChemMol, Hangzhou Trylead
Chemical Technology, IS Chemical Technology, MolPort, Sigma-Aldrich, TCI (Tokyo Chemical Industry), Vitas-M Laboratory, ZINC, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |