[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Ium-1-Id-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3S,4S)-2,3,4-Trihydroxy-5-[(24R,25R,36S,45R)-25-Hydroxy-16,17-Dimethyl-31,32-Dioxo-24-Phenyl-Blahtetracyclo[Blah.Blah.Blah.Blah.Blah]Heptadeca-8(16),9(17),19-Trien-44-Yl]Pentyl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C36H45N9O16P2 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-ium-1-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4s)-2,3,4-trihydroxy-5-[(24r,25r,36s,45r)-25-hydroxy-16,17-dimethyl-31,32-dioxo-24-phenyl-blahtetracyclo[blah.blah.blah.blah.blah]heptadeca-8(16),9(17),19-trien-44-yl]pentyl] hydrogen phosphate |
| Molecular Mass | 921.741 g·mol−1 |
| Heat of Formation | -3117.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.59 ± 1.08 D |
| Volume | 966.41 Å 3 |
| Surface Area | 661.89 Å 2 |
| HOMO Energy | -8.63 ± 0.55 eV |
| LUMO Energy | -1.61 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QJHXPRIECILERF-LHVNJQMSSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |