| Compound | 9'-(o-methyl)protocetraric acid |
| NPACT-Id | NPACT01543 |
| IUPAC | - |
| Synonyms | - |
| PubChem Id | - |
| Class | Unknown |
| In-vitro anticancer activity | 6 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | IJJZZLYYFYYEHT-UHFFFAOYSA-N |
| InChi | 1S/C19H16O9/c1-7-4-11(21)9(5-20)16-12(7)19(25)28-17-10(6-26-3)14(22)13(18(23)24)8(2)15(17)27-16/h4-5,21-22H,6H2,1-3H3,(H,23,24) |
| SMILES | C1(=O)Oc2c(Oc3c(c(cc(c13)C)O)C=O)c(c(c(c2COC)O)C(=O)O)C |
|
SMART | [H]C(=O)C1=C2OC3=C(OC(=O)C2=C([#6])C=C1O)C(CO[#6])=C(O)C(C(O)=O)=C3[#6] |
| 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 | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |