5'-O-[{[{[(3Ar,5R,6R,6Ar)-2,6-Dihydroxy-2-Oxidotetrahydrofuro[2,3-D][1,3,2]Dioxaphosphol-5-Yl]Methoxy}(Hydroxy)Phosphoryl]Oxy}(Hydroxy)Phosphoryl]Adenosine
Properties
Property | Value |
---|---|
Formula | C15H22N5O16P3 |
IUPAC Name | [[(2s,3ar,5r,6r,6ar)-2,6-dihydroxy-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-5-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
Molecular Mass | 621.280 g·mol−1 |
Heat of Formation | -3524.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.36 ± 1.08 D |
Volume | 587.08 Å 3 |
Surface Area | 415.27 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -1.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | NPSPRYXPOGPCPM-KEOHHSTQSA-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 |