[[(2R,3S,4R,5R)-5-(6-Amino-2H-Purin-9-Ium-2-Ylium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3S,4S)-5-[(28R,29R,43S,51R)-28-(2-Benzyloxy-3-Fluoro-Phenyl)-29-Hydroxy-20,21-Dimethyl-37,39-Dioxo-45,49,50,51-Tetrazatetracyclo[Blah.Blah.Blah.Blah.Blah]Heptadeca-11(20),12(21),25,38(49)-Tetraen-50-Yl]-2,3,4-Trihydroxy-Pentyl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C43H48FN9O17P2 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-amino-2h-purin-9-ium-2-ylium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4s)-5-[(28r,29r,43s,51r)-28-(2-benzyloxy-3-fluoro-phenyl)-29-hydroxy-20,21-dimethyl-37,39-dioxo-45,49,50,51-tetrazatetracyclo[blah.blah.blah.blah.blah]heptadeca-11(20),12(21),25,38(49)-tetraen-50-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate |
| Molecular Mass | 1043.837 g·mol−1 |
| Heat of Formation | -3233.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.97 ± 1.08 D |
| Volume | 1118.65 Å 3 |
| Surface Area | 852.51 Å 2 |
| HOMO Energy | -8.75 ± 0.55 eV |
| LUMO Energy | -1.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UZFFWEYCLNPHAX-BJXRDEIQSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N P |