Compound | Taiwaniaquinone D |
NPACT-Id | NPACT01523 |
IUPAC | (4aS)-8-hydroxy-1,1,4a-trimethyl-5,6-dioxo-7-propan-2-yl-3,4-dihydro-2H-fluorene-9-carbaldehyde |
Synonyms | - |
PubChem Id | 11962188 |
Class | Terpenoids |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | RQYVSWXPOCVYOG-HXUWFJFHSA-N |
InChi | 1S/C20H24O4/c1-10(2)12-15(22)13-11(9-21)18-19(3,4)7-6-8-20(18,5)14(13)17(24)16(12)23/h9-10,22H,6-8H2,1-5H3/t20-/m1/s1 |
SMILES | OC1=C(C(=O)C(=O)C2=C1C(=C1[C@@]2(CCCC1(C)C)C)C=O)C(C)C |
SMART | [#6]C([#6])C1=C(O)C2=C(C(=O)C1=O)[C@@]1([#6])CCCC([#6])([#6])C1=C2C=O |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | C516089 |
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 |