| Compound | arteglasin A |
| NPACT-Id | NPACT01140 |
| IUPAC | - |
| Synonyms | (3ar,4s,7ar,8as,8bs,8cs)-6,8a-dimethyl-3-methylidene-2-oxo-2,3,3a,4,5,7,7a,8a,8b,8c-decahydrooxireno[2,3]azuleno[4,5-b]furan-4-yl acetate;Arteglasin A;Oxireno(2,3)azuleno(4,5-b)furan-2(3H)-one, 4-(acetyloxy)-3a,4,5,7,7a,8a,8b,8c-octahydro-6,8a-dimethyl-3-methylene-, (3aR-(3aalpha,4alpha,7abeta,8abeta,8balpha,8cbeta))- |
| PubChem Id | 169494 |
| 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 | IJNUSISHBLGZMG-JMZZHWKLSA-N |
| InChi | 1S/C17H20O5/c1-7-5-11(20-9(3)18)13-8(2)16(19)21-15(13)14-10(7)6-12-17(14,4)22-12/h11-15H,2,5-6H2,1,3-4H3/t11-,12+,13+,14-,15-,17+/m0/s1 |
| SMILES | O1[C@]2([C@H]3C(=C(C[C@H](OC(=O)C)[C@@H]4[C@@H]3OC(=O)C4=C)C)C[C@@H]12)C |
|
SMART | [H]C([H])=C1/C(=O)O[C@@]2([H])[C@@]1([H])[C@@]([H])(OC(=O)C([H])([H])[H])C([H])([H])C(=C1C([H])([H])[C@@]3([H])O[C@@]3(C([H])([H])[H])[C@]21[H])C([H])([H])[H] |
| CAS No. | 33204-39-6 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | AAA Chemistry, ABI Chem, Kingston Chemistry, |
| 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 |