[[(2R,3S,4S)-5-[(4As,10S,10Ar)-7,8-Dimethyl-2,4-Dioxo-1,4A,5,10A-Tetrahydrobenzo[G]Pteridin-10-Yl]-2,3,4-Trihydroxy-Pentoxy]-Hydroxy-Phosphoryl] [(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C27H39N9O15P2 |
| IUPAC Name | [[(2r,3s,4s)-5-[(4as,10s,10ar)-7,8-dimethyl-2,4-dioxo-1,4a,5,10a-tetrahydrobenzo[g]pteridin-10-yl]-2,3,4-trihydroxy-pentoxy]-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 791.597 g·mol−1 |
| Heat of Formation | -3013.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.17 ± 1.08 D |
| Volume | 806.25 Å 3 |
| Surface Area | 652.44 Å 2 |
| HOMO Energy | -8.58 ± 0.55 eV |
| LUMO Energy | -1.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YYBAYPADXFQJRM-AWYOOINRSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |