Compound | Agehoustin B |
NPACT-Id | NPACT01119 |
IUPAC | - |
Synonyms | 5,6,7-trimethoxy-2-(2,3,4,5-tetramethoxyphenyl)chromen-4-one |
PubChem Id | 389484 |
Class | Flavonoid |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | CNWLLDUECPZGHJ-UHFFFAOYSA-N |
InChi | 1S/C22H24O9/c1-24-15-8-11(18(26-3)22(30-7)20(15)28-5)13-9-12(23)17-14(31-13)10-16(25-2)19(27-4)21(17)29-6/h8-10H,1-7H3 |
SMILES | o1c(c2c(OC)c(OC)c(OC)c(OC)c2)cc(=O)c2c1cc(OC)c(OC)c2OC |
SMART | [H]C1=C(OC2=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C2C1=O)C1=C([H])C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C1OC([H])([H])[H] |
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 | ABI Chem, |
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 |