| Compound | damsin |
| NPACT-Id | NPACT01182 |
| IUPAC | - |
| Synonyms | Damsine;Ambrosin, dihydro-;Dihydroambrosin;Decahydro-6,9a-dimethyl-3-methylene-azuleneo(4,5-b)furan-2,9-dione;10-alpha-H-AMBROS-11(13)-EN-12-OIC ACID, 6-beta-HYDROXY-4-OXO-, gamma-LACTONE;Azulene derivative; |
| PubChem Id | 14631 |
| Class | Terpenoids |
| In-vitro anticancer activity | 2 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | HPJYKMSFRBJOSW-JHSUYXJUSA-N |
| InChi | 1S/C15H20O3/c1-8-4-5-10-9(2)14(17)18-13(10)15(3)11(8)6-7-12(15)16/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10-,11-,13+,15-/m0/s1 |
| SMILES | O1[C@H]2[C@]3([C@H]([C@H](CC[C@H]2C(=C)C1=O)C)CCC3=O)C |
|
SMART | [H]C([H])=C1/C(=O)O[C@]2([H])[C@@]1([H])C([H])([H])C([H])([H])[C@]([H])(C([H])([H])[H])[C@]1([H])C([H])([H])C([H])([H])C(=O)[C@@]21C([H])([H])[H] |
| CAS No. | 1216-42-8 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C012266 |
| 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 |