9-{5-O-[{[(2S)-2-Acetamido-3-Phenylpropanoyl]Oxy}(Hydroxy)Phosphoryl]-D-Ribofuranosyl}-9H-Purin-6-Amine
Properties
Property | Value |
---|---|
Formula | C21H25N6O9P |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] (2s)-2-acetamido-3-phenyl-propanoate |
Molecular Mass | 536.432 g·mol−1 |
Heat of Formation | -1608.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.93 ± 1.08 D |
Volume | 585.23 Å 3 |
Surface Area | 479.74 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | -0.85 ± eV |
Point Group Symmetry | C1 |
InChIKey | FFKXWHUDDARDBW-SWQDORGXSA-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 |