2'-O-[2-(Methylamino)Benzoyl]Adenosine 5'-(Tetrahydrogen Triphosphate)
Properties
| Property | Value |
|---|---|
| Formula | C18H23N6O14P3 |
| IUPAC Name | [(2r,3r,4r,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphoryl]oxymethyl]tetrahydrofuran-3-yl] 2-(methylamino)benzoate |
| Molecular Mass | 640.328 g·mol−1 |
| Heat of Formation | -3114.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.67 ± 1.08 D |
| Volume | 635.78 Å 3 |
| Surface Area | 504.36 Å 2 |
| HOMO Energy | -8.70 ± 0.55 eV |
| LUMO Energy | -1.25 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OTIXVXNMFVNGEF-HVOFVXBASA-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 |