Compound | 5-desmethylnobiletin |
NPACT-Id | NPACT00172 |
IUPAC | 2-(3,4-dimethoxyphenyl)-3,5-dihydroxy-6,7,8-trimethoxychromen-4-one |
Synonyms | - |
PubChem Id | 10453852 |
Class | Flavonoid |
In-vitro anticancer activity | 6 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | DXVIBUVPWYGAJO-UHFFFAOYSA-N |
InChi | 1S/C20H20O9/c1-24-10-7-6-9(8-11(10)25-2)16-15(23)13(21)12-14(22)18(26-3)20(28-5)19(27-4)17(12)29-16/h6-8,22-23H,1-5H3 |
SMILES | o1c2c(c(O)c(OC)c(OC)c2OC)c(=O)c(O)c1c1cc(OC)c(OC)cc1 |
SMART | [#6]OC1=C(O[#6])C=C(C=C1)C1=C(O)C(=O)C2=C(O)C(O[#6])=C(O[#6])C(O[#6])=C2O1 |
CAS No. | - |
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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 |