| General Property |
| Molceule ID (DB) | EGIN0004124 |
| Inhibitor Class | Alternaria(Extract) |
| Molecule Name in Refrence Article | 15 compound |
| IUPAC Name | (1S,12aR,12bS)-1,4,9,12a-tetrahydroxy-1,2,3,10,11,12,12a,12b-octahydroperylene-3,10-dione |
| Formula | C20H16O6 |
| Mass | 352.3374 |
| Exact Mass | 352.0946882 |
| Composition | C (68.18%), H (4.58%), O (27.25%) |
| Atom Count | 42 |
| PI | 3.24 |
| Smiles | c1cc2c3ccc(c4c3[C@H]([C@]3(c2c(c1O)C(=O)CC3)O)[C@H](CC4=O)O)O |
| InChI | 1S/C20H16O6/c21-10-3-1-8-9-2-4-11(22)17-12(23)5-6-20(26,18(9)17)19-14(25)7-13(24)16(10)15(8)19/h1-4,
14,19,21-22,25-26H,5-7H2/t14-,19+,20-/m0/s1 |
| InChIKey | GJIALGLHOBXNAT-KPOBHBOGSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| 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 | 18494522 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | ARK5 | Aurora A | Aurora B | B-RAF-VE | CDK4/CycD1 | COT | EPHB4 | FAK | FLT3 | IGF1R | InsR | MET | PDGFR beta | SAK | SRC | TIE2 | VEGFR2 | VEGFR3 | ALL |
| Pub Chem Link |
104860
|
| Drug Bank Link | - |
| ChemSpider Link | 94648 |
| ChEMBL Link | CHEMBL521470 |
