N-[(2E)-4-Hydroxy-3-Methyl-2-Buten-1-Yl]-2-(Methylsulfanyl)Adenosine
Properties
| Property | Value |
|---|---|
| Formula | C16H23N5O5S |
| IUPAC Name | (2s,3r,4r,5r)-2-(hydroxymethyl)-5-[6-[[(e)-4-hydroxy-3-methyl-but-2-enyl]amino]-2-methylsulfanyl-purin-9-ium-9-yl]tetrahydrofuran-3,4-diol |
| Molecular Mass | 397.449 g·mol−1 |
| Heat of Formation | -677.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.17 ± 1.08 D |
| Volume | 451.22 Å 3 |
| Surface Area | 375.3 Å 2 |
| HOMO Energy | -8.62 ± 0.55 eV |
| LUMO Energy | -0.98 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QEWSGVMSLPHELX-YHVSIODTSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |