Compound | Vismiaguianone E |
NPACT-Id | NPACT01507 |
IUPAC | 8-benzoyl-5,7-dihydroxy-6-(3-methylbut-2-enyl)-4-phenyl-3,4-dihydrochromen-2-one |
Synonyms | - |
PubChem Id | 10071240 |
Class | Simple aromatic natural products |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | BKIBEPYJFMPNLS-UHFFFAOYSA-N |
InChi | 1S/C27H24O5/c1-16(2)13-14-19-25(30)22-20(17-9-5-3-6-10-17)15-21(28)32-27(22)23(26(19)31)24(29)18-11-7-4-8-12-18/h3-13,20,30-31H,14-15H2,1-2H3 |
SMILES | O1c2c(C(CC1=O)c1ccccc1)c(O)c(c(O)c2C(=O)c1ccccc1)CC=C(C)C |
SMART | [#6]C([#6])=CCC1=C(O)C(C(=O)C2=CC=CC=C2)=C2OC(=O)CC(C3=CC=CC=C3)C2=C1O |
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 | No |
Ghose filter | No |
Veber filter | Yes |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |