[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl 9-[(8R,9S,13S,14S,16S,17S)-3,17-Dihydroxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-16-Yl]Nonanoate
Properties
| Property | Value |
|---|---|
| Formula | C37H53N5O7 |
| IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 9-[(8r,9s,13s,14s,16s,17s)-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]nonanoate |
| Molecular Mass | 679.846 g·mol−1 |
| Heat of Formation | -1190.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.54 ± 1.08 D |
| Volume | 821.08 Å 3 |
| Surface Area | 686.25 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | -0.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UOWKHWKHMNZVGX-KTXOUVACSA-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 |