| General Property |
| Molceule ID (DB) | EGIN0004142 |
| Inhibitor Class | Homo-isoflavonoids |
| Molecule Name in Refrence Article | 14 compound |
| IUPAC Name | (3R,4S)-3-[(4-hydroxyphenyl)methyl]-4-methoxy-3,4-dihydro-2H-1-benzopyran-3,7-diol |
| Formula | C17H18O5 |
| Mass | 302.3218 |
| Exact Mass | 302.1154237 |
| Composition | C (67.54%), H (6%), O (26.46%) |
| Atom Count | 40 |
| PI | 2.79 |
| Smiles | c12cc(ccc1[C@@H]([C@](CO2)(Cc1ccc(cc1)O)O)OC)O |
| InChI | 1S/C17H18O5/c1-21-16-14-7-6-13(19)8-15(14)22-10-17(16,20)9-11-2-4-12(18)5-3-11/h2-8,16,18-20H,9-10H2
,1H3/t16-,17+/m0/s1 |
| InChIKey | NRDMATSOBGRQDO-DLBZAZTESA-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 | FGFR1 | c-kit | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 10404376 |
| ChEMBL Link | CHEMBL518739 |
