| General Property |
| Molceule ID (DB) | EGIN0004137 |
| Inhibitor Class | Homo-isoflavonoids |
| Molecule Name in Refrence Article | HEMATOXYLONE |
| IUPAC Name | (3R)-3-[(3,4-dihydroxyphenyl)methyl]-3,7,8-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one |
| Formula | C16H14O7 |
| Mass | 318.2782 |
| Exact Mass | 318.0739528 |
| Composition | C (60.38%), H (4.43%), O (35.19%) |
| Atom Count | 37 |
| PI | 1.94 |
| Smiles | c12c(c(ccc1C(=O)[C@](CO2)(Cc1ccc(c(c1)O)O)O)O)O |
| InChI | 1S/C16H14O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,17-20,22H,6-7
H2/t16-/m1/s1 |
| InChIKey | JUJOJJFIOBKCID-MRXNPFEDSA-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 | KDR | c-kit | FGFR2 | c-Met | c-Src | FGFR1 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 24699447 |
| ChEMBL Link | CHEMBL477768 |
