5'-O-[(R)-{[(2S)-2-Amino-6-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Hexanoyl]Oxy}(Hydroxy)Phosphoryl]Adenosine
Properties
Property | Value |
---|---|
Formula | C21H34N7O10P |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-ium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] (2s)-2-amino-6-(tert-butoxycarbonylamino)hexanoate |
Molecular Mass | 575.509 g·mol−1 |
Heat of Formation | -2009.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.86 ± 1.08 D |
Volume | 649.01 Å 3 |
Surface Area | 543.94 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | -0.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | XYDQQGDGPLGSGU-URQYDQELSA-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 |