| Formula |
C20H24N8O13P2S2 |
| IUPAC Name |
[(2r,3r,4r,5r)-4-[[(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-thioxo-3h-purin-9-yl)tetrahydrofuran-2-yl]methoxy]-3-hydroxy-5-(6-thioxo-3h-purin-9-yl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate |
| Molecular Mass |
710.528 g·mol−1 |
| Heat of Formation |
-2315.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
18.02 ± 1.08 D |
| Volume |
698.88 Å 3 |
| Surface Area |
465.16 Å 2 |
| HOMO Energy |
-8.43 ± 0.55 eV |
| LUMO Energy |
-1.69 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [(2r,3r,4r,5r)-4-[[(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-thioxo-3h-purin-9-yl)-2-tetrahydrofuranyl]methoxy]-3-hydroxy-5-(6-thioxo-3h-purin-9-yl)-2-tetrahydrofuranyl]methyl phosphono hydrogen phosphate
- bis(mprp)
- inosine 5'-(trihydrogen diphosphate), 6-thio-, 5'-5'-ester with 6-thioinosine
- p(1),p(2)-bis(6-mercaptopurine-9 beta-ribofuranoside)-5'-pyrophosphate
|
| CAS Number(s) |
|
| InChIKey |
LPIKNCIDBJMEJO-XPWFQUROSA-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
|
| |
|
