Compound | 7-Hydroxy-8-methoxy-3-(4'-hydroxybenzyl)coumarin |
NPACT-Id | NPACT01435 |
IUPAC | 7-hydroxy-3-[(4-hydroxyphenyl)methyl]-6-methoxychromen-2-one |
Synonyms | - |
PubChem Id | 44479224 |
Class | Benzopyranoids |
In-vitro anticancer activity | 5 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | AEFXNURLAGMDLH-UHFFFAOYSA-N |
InChi | 1S/C17H14O5/c1-21-16-8-11-7-12(6-10-2-4-13(18)5-3-10)17(20)22-15(11)9-14(16)19/h2-5,7-9,18-19H,6H2,1H3 |
SMILES | o1c2c(cc(Cc3ccc(O)cc3)c1=O)cc(OC)c(O)c2 |
SMART | [#6]OC1=C(O)C=C2OC(=O)C(CC3=CC=C(O)C=C3)=CC2=C1 |
CAS No. | - |
|
Structure Download |
|
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 |