S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-Purin-9-Yl)-4-Hydroxy-3-(Phosphonooxy)Tetrahydro-2-Furanyl]-3,5,9-Trihydroxy-8,8-Dimethyl-3,5-Dioxido-10,14-Dioxo-2,4,6-Trioxa-11,15-Diaza-3Lambda~5~,5Lambda~5~-Diphosphaheptadecan-17-Yl} (2R)-2-Methyltetradecanethioate
Properties
| Property | Value |
|---|---|
| Formula | C36H66N7O17P3S |
| IUPAC Name | aminomethylene-[amino-[(1s)-1-(3-oxopenta-1,4-diynyl)-1h-imidazole-1,3-diium-4-yl]methylene]ammonium; (e)-ethylidene-[3-[[(2z)-2-hydroxy-2-(2-oxocyclobutylidene)acetyl]amino]propanoyl]ammonium; hydron; phosphenic acid; phosphooxy hydrogen phosphite; sulfanylmethanol; 1-undecylcyclopropene; dihydrate |
| Molecular Mass | 1006.028 g·mol−1 |
| Heat of Formation | -2574.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.64 ± 1.08 D |
| Volume | 1232.54 Å 3 |
| Surface Area | 1033.52 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | -1.88 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KJEFZXSIQKASDI-MOTPQXBDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |