| Compound | 14,15-beta-dihydroxyklaineanone |
| NPACT-Id | NPACT01409 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | 10883790 |
| 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 | NWNMAVFXIRDAPM-RELKVJPISA-N |
| InChi | 1S/C20H28O8/c1-7-5-10(21)15(24)18(3)9(7)6-11-19(4)14(18)13(23)12(22)8(2)20(19,27)16(25)17(26)28-11/h5,8-9,11-16,22-25,27H,6H2,1-4H3/t8-,9-,11+,12+,13-,14+,15+,16-,18-,19+,20-/m0/s1 |
| SMILES | O1[C@H]2[C@@]3([C@@H]([C@@]4([C@@H](C2)C(=CC(=O)[C@H]4O)C)C)[C@@H](O)[C@H](O)[C@@H]([C@]3(O)[C@@H](O)C1=O)C)C |
|
SMART | [#6][C@H]1[C@@H](O)[C@H](O)[C@@H]2[C@@]3([#6])[C@H](O)C(=O)C=C([#6])[C@@H]3C[C@H]3OC(=O)[C@H](O)[C@]1(O)[C@@]23[#6] |
| CAS No. | - |
|
Structure
Download | 
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| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | No |
| Veber filter | No |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |