| Compound | Brasiliensic acid |
| NPACT-Id | NPACT01544 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Benzopyranoids |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | YJAPDIVWYCOPNE-UHFFFAOYSA-N |
| InChi | 1S/C32H46O6/c1-10-11-23(16-25(33)34)26-29-27(28(35)21(8)22(9)38-29)31(37)32(30(26)36,15-14-19(4)5)17-24(20(6)7)13-12-18(2)3/h14,21-24,37H,2,6,10-13,15-17H2,1,3-5,7-9H3,(H,33,34) |
| SMILES | C1(=C2C(=C(C(=O)C1(CC=C(C)C)CC(CCC(=C)C)C(=C)C)C(CC(=O)O)CCC)OC(C(C2=O)C)C)O |
|
SMART | [#6]CCC(CC(O)=O)C1=C2OC([#6])C([#6])C(=O)C2=C(O)C(CC=C([#6])[#6])(CC(CCC([#6])=C)C([#6])=C)C1=O |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |