(2R)-2-{(9R,10S)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-Purin-9-Yl)-4-Hydroxy-3-(Phosphonooxy)Tetrahydro-2-Furanyl]-3,5,9,10-Tetrahydroxy-8,8-Dimethyl-3,5-Dioxido-14,19-Dioxo-2,4,6-Trioxa-11,15-Diaza-3Lambda~5~,5Lambda~5~-Diphosphaicosan-20-Yl}-2-Hydroxysuccinic Acid
Properties
| Property | Value |
|---|---|
| Formula | C28H46N7O22P3 |
| IUPAC Name | (2r)-2-[5-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-1,2-dihydroxy-3,3-dimethyl-butyl]amino]propanoylamino]-2-oxo-pentyl]-2-hydroxy-butanedioic acid |
| Molecular Mass | 925.620 g·mol−1 |
| Heat of Formation | -942.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 28.14 ± 1.08 D |
| Volume | 794.02 Å 3 |
| Surface Area | 609.76 Å 2 |
| HOMO Energy | -7.97 ± 0.55 eV |
| LUMO Energy | -2.72 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JCKIRWYQPYQCEC-LWCHDFGBSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C O N |