| Compound | Rhinacanthin C |
| NPACT-Id | NPACT00908 |
| IUPAC | [3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)-2,2-dimethylpropyl](2E,6E)-2,6-dimethylocta-2,6-dienoate |
| Synonyms | - |
| PubChem Id | 6474554 |
| Class | Polycyclic aromatic natural products |
| In-vitro anticancer activity | 5 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | CASP3 | COX-2 | PTGER3 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | CEPGYONTKGWENW-QIGLBIQCSA-N |
| InChi | 1S/C25H30O5/c1-6-16(2)10-9-11-17(3)24(29)30-15-25(4,5)14-20-21(26)18-12-7-8-13-19(18)22(27)23(20)28/h6-8,11-13,26H,9-10,14-15H2,1-5H3/b16-6+,17-11+ |
| SMILES | O(CC(CC1=C(O)c2c(C(=O)C1=O)cccc2)(C)C)C(=O)/C(=C/CC/C(=C/C)/C)/C |
|
SMART | [H]OC1=C(C(=O)C(=O)C2=C([H])C([H])=C([H])C([H])=C12)C([H])([H])[C@](C([H])([H])[H])(C([H])([H])[H])C([H])([H])OC(=O)C(=C(/[H])C([H])([H])C([H])([H])C(=C(/[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H] |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C515073 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |