[[5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [5-[3-Carbamoyl-4-(1-Methyl-2-Oxo-Butyl)Pyridin-1-Ium-1-Yl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphate
Properties
Property | Value |
---|---|
Formula | C26H35N7O15P2 |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-[3-carbamoyl-4-[(1s)-1-methyl-2-oxo-butyl]pyridin-1-ium-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphate |
Molecular Mass | 747.542 g·mol−1 |
Heat of Formation | -3008.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.45 ± 1.08 D |
Volume | 770.06 Å 3 |
Surface Area | 514.31 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | -1.51 ± eV |
Point Group Symmetry | C1 |
InChIKey | BZJFKYRGSZWSLT-YLIVDTKOSA-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 |