Compound | Rhinacanthin B |
NPACT-Id | NPACT00907 |
IUPAC | - |
Synonyms | - |
PubChem Id | - |
Class | Polycyclic aromatic natural products |
In-vitro anticancer activity | 5 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | FJJLEZNYBRUPKT-VMXGVUMBSA-N |
InChi | 1S/C25H28O5/c1-6-15(2)10-9-11-16(3)24(28)29-20-14-19-21(26)17-12-7-8-13-18(17)22(27)23(19)30-25(20,4)5/h6-8,11-13,20H,9-10,14H2,1-5H3/b15-6+,16-11+/t20-/m1/s1 |
SMILES | c1cccc2c1C(=O)C1=C(C2=O)C[C@H](C(O1)(C)C)OC(=O)/C(=C/CC/C(=C/C)/C)/C |
SMART | [#6]C=C(/[#6])CCC=C(/[#6])C(=O)O[C@@H]1CC2=C(O[C@]1([#6])[#6])C(=O)C1=CC=CC=C1C2=O |
CAS No. | 119626-46-9 |
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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 |