Compound | Rhinacanthin K |
NPACT-Id | NPACT00913 |
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 | FLJQRHBQUIFRIX-NHBAIXJCSA-N |
InChi | 1S/C25H32O7/c1-15(9-8-12-25(5,31)16(2)26)23(30)32-14-24(3,4)13-19-20(27)17-10-6-7-11-18(17)21(28)22(19)29/h6-7,9-11,16,26,29,31H,8,12-14H2,1-5H3/b15-9+/t16-,25+/m0/s1 |
SMILES | c1cccc2c1C(=O)C(=C(C2=O)O)CC(C)(C)COC(=O)/C(=C/CC[C@@]([C@H](C)O)(C)O)/C |
SMART | O[C@@H]([#6])[C@@](O)([#6])CCC=C(/[#6])C(=O)OC[C@@]([#6])([#6])CC1=C(O)C(=O)C2=CC=CC=C2C1=O |
CAS No. | 205653-93-6 |
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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 |