(2S,5S)-2-Amino-6-[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]-5-(Propylamino)Hexanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H31N7O5 |
| IUPAC Name | (2s,5s)-2-amino-6-[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-5-(propylamino)hexanoic acid |
| Molecular Mass | 425.483 g·mol−1 |
| Heat of Formation | -767.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.55 ± 1.08 D |
| Volume | 499.07 Å 3 |
| Surface Area | 419.91 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ONTKJSXUZCANMV-GTAFEMJLSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |