4-Amino-1-{5-O-[{[{[(8Xi,9Xi,11β,14Xi)-11,17-Dihydroxy-3,20-Dioxopregn-4-En-21-Yl]Oxy}(Hydroxy)Phosphoryl]Oxy}(Hydroxy)Phosphoryl]-β-D-Arabinofuranosyl}-2(1H)-Pyrimidinone
Properties
| Property | Value |
|---|---|
| Formula | C30H43N3O15P2 |
| IUPAC Name | [[(2r,3s,4s,5r)-5-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [2-[(8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] hydrogen phosphate |
| Molecular Mass | 747.621 g·mol−1 |
| Heat of Formation | -3258.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.67 ± 1.08 D |
| Volume | 814.11 Å 3 |
| Surface Area | 605.54 Å 2 |
| HOMO Energy | -9.54 ± 0.55 eV |
| LUMO Energy | -1.35 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OMJRRQBPMDOUQI-KEROKREJSA-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 |