| General Property |
| Molceule ID (DB) | EGIN0004146 |
| Inhibitor Class | Homo-isoflavonoids |
| Molecule Name in Refrence Article | PROTOSAPPANIN A |
| IUPAC Name | 5,14,15-trihydroxy-8-oxatricyclo[10.4.0.0^{2,7}]hexadeca-1(16),2(7),3,5,12,14-hexaen-10-one |
| Formula | C15H12O5 |
| Mass | 272.2528 |
| Exact Mass | 272.0684735 |
| Composition | C (66.17%), H (4.44%), O (29.38%) |
| Atom Count | 32 |
| PI | 1.97 |
| Smiles | c1c(ccc2c1OCC(=O)Cc1c2cc(c(c1)O)O)O |
| InChI | 1S/C15H12O5/c16-9-1-2-11-12-6-14(19)13(18)4-8(12)3-10(17)7-20-15(11)5-9/h1-2,4-6,16,18-19H,3,7H2 |
| InChIKey | MUKYVRVYBBYJSI-UHFFFAOYSA-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 | ALL |
| Pub Chem Link |
128001
|
| Drug Bank Link | - |
| ChemSpider Link | 113511 |
| ChEMBL Link | CHEMBL447427 |
