| General Property |
| Molceule ID (DB) | EGIN0000602 |
| Inhibitor Class | Naphtho-furo-quinone |
| Molecule Name in Refrence Article | 9 compound |
| IUPAC Name | methyl (2R,11R)-20-[3-(dimethylamino)propoxy]-3,10-dioxo-12-oxapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{14,19}]henicosa-1(13),4,6,8,14(19),15,17,20-octaene-21-carboxylate |
| Formula | C27H25NO6 |
| Mass | 459.4905 |
| Exact Mass | 459.1681875 |
| Composition | C (70.58%), H (5.48%), N (3.05%), O (20.89%) |
| Atom Count | 59 |
| PI | 7.07 |
| Smiles | c12c(cccc1)C(=O)[C@H]1[C@H](C2=O)c2c(O1)c1c(c(c2C(=O)OC)OCCCN(C)C)cccc1 |
| InChI | 1S/C27H25NO6/c1-28(2)13-8-14-33-24-17-11-6-7-12-18(17)25-19(21(24)27(31)32-3)20-22(29)15-9-4-5-10-16
(15)23(30)26(20)34-25/h4-7,9-12,20,26H,8,13-14H2,1-3H3/t20-,26+/m0/s1 |
| InChIKey | NORSRZQVJWQNRC-RXFWQSSRSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 16321529 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PDGFR beta | VEGFR2 | FGFR1 | FGFR1 | PDGFR beta | VEGFR2 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL383030 |
