1-Deoxy-1-[(4Ar)-4A-[(2R)-1-Hydroxy-5-{[(S)-Hydroxy(Phosphonooxy)Phosphoryl]Oxy}-3-Methylene-2-Pentanyl]-7,8-Dimethyl-2,4-Dioxo-3,4,4A,5-Tetrahydrobenzo[G]Pteridin-10(2H)-Yl]-5-O-Phosphono-D-Ribitol
Properties
| Property | Value |
|---|---|
| Formula | C23H35N4O17P3 |
| IUPAC Name | [(4r)-4-[(4ar)-7,8-dimethyl-2,4-dioxo-10-[(2s,3s,4r)-2,3,4-trihydroxy-5-phosphonooxy-pentyl]-5h-benzo[g]pteridin-4a-yl]-5-hydroxy-3-methylene-pentyl] phosphono hydrogen phosphate |
| Molecular Mass | 732.462 g·mol−1 |
| Heat of Formation | -3917.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.06 ± 1.08 D |
| Volume | 759.96 Å 3 |
| Surface Area | 573.0 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | -1.39 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KSKIGIXASYOSHG-TUUFUFLPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |