| General Property |
| Molceule ID (DB) | EGIN0004140 |
| Inhibitor Class | Homo-isoflavonoids |
| Molecule Name in Refrence Article | ISOHEMATOXYLIN |
| IUPAC Name | (1S,10S)-8-oxatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-2,4,6,12,14,16-hexaene-5,6,10,15,16-pentol |
| Formula | C16H14O6 |
| Mass | 302.2788 |
| Exact Mass | 302.0790382 |
| Composition | C (63.57%), H (4.67%), O (31.76%) |
| Atom Count | 36 |
| PI | 2.81 |
| Smiles | c12c(c(c(cc1)O)O)[C@H]1[C@@](C2)(COc2c1ccc(c2O)O)O |
| InChI | 1S/C16H14O6/c17-9-3-1-7-5-16(21)6-22-15-8(2-4-10(18)14(15)20)12(16)11(7)13(9)19/h1-4,12,17-21H,5-6H2
/t12-,16+/m0/s1 |
| InChIKey | NQLVZUJHUSTZEF-BLLLJJGKSA-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 | 18610999 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | FGFR2 | c-kit | KDR | c-Src | c-Met | FGFR1 | ALL |
| Pub Chem Link |
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|
| Drug Bank Link | - |
| ChemSpider Link | 24687324 |
| ChEMBL Link | CHEMBL447506 |
