Compound | Dehydrocostuslactone |
NPACT-Id | NPACT00483 |
IUPAC | (3aS,6aR,9aR,9bS)-3,6,9-trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one |
Synonyms | dehydrocostuslactone |
PubChem Id | 73174 |
Class | Terpenoids |
In-vitro anticancer activity | 2 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | JAK1 | JAK2 | STAT3 | All | |
Properties | Physical Elemental Topological |
InChi Key | NETSQGRTUNRXEO-XUXIUFHCSA-N |
InChi | 1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h11-14H,1-7H2/t11-,12-,13-,14-/m0/s1 |
SMILES | O1[C@@H]2[C@@H]3[C@@H](CCC3=C)C(=C)CC[C@H]2C(=C)C1=O |
SMART | [H]C([H])=C1C(=O)O[C@@]2([H])[C@@]1([H])C([H])([H])C([H])([H])C(=C([H])[H])[C@]1([H])C([H])([H])C([H])([H])C(=C([H])[H])[C@]21[H] |
CAS No. | 477-43-0 |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | C083030 |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | AAA Chemistry, ABI Chem, Ambinter, ChemMol, FINETECH, IS Chemical Technology, Kingston Chemistry, ZINC, |
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 |