General Property |
Molceule ID (DB) | EGIN0005082 |
Inhibitor Class | Curcumin |
Molecule Name in Refrence Article | I11 |
IUPAC Name | (2E,6E)â€2â€(cyclohexylmethylidene)â€6â€[(3,5â€dimethoxyphenyl)methylidene]cyclohexanâ€1â€one |
Formula | C23H24O4 |
Mass | 364.4343 |
Exact Mass | 364.167459256 |
Composition | C (75.8%), H (6.64%), O (17.56%) |
Atom Count | 51 |
PI | - |
Smiles | [H]C(C1=C([H])C([H])=C([H])C(OC([H])([H])[H])=C1[H])=C1/C(=O)/C(=C([H])C2=C([H])C(OC([H])([H])[H])=C([H])C(OC([H])([H])[H])=C2[H])C([H])([H])C([H])([H])C1([H])[H] |
InChI | 1S/C23H24O4/c1-25-20-9-4-6-16(12-20)10-18-7-5-8-19(23(18)24)11-17-13-21(26-2)15-22(14-17)27-3/h4,6,9
-15H,5,7-8H2,1-3H3/b18-10+,19-11+ |
InChIKey | NAAUBJFDXWTYOS-XOBNHNQQSA-N |
2D Structure | | Structure Backbone | |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 23245570 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
71508649
|
Drug Bank Link | - |
ChemSpider Link | 29398779 |
ChEMBL Link | CHEMBL2316157 |