Triphosphoric Acid, Mono[[(2S,5R)-5-(6-Amino-9H-Purin-9-Yl)Tetrahydro-2-Furanyl]Methyl] Ester

Molecule SVG Image

Properties Simple | Detailed

Formula C10H16N5O11P3
IUPAC Name [[(2s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 475.182 g·mol−1
Heat of Formation -2702.7 ± 16.7 kJ·mol−1
Dipole Moment 3.31 ± 1.08 D
Volume 453.53 Å 3
Surface Area 390.96 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -1.42 ± eV
Point Group Symmetry C1
Synonyms
  • 2',3'-dideoxy-atp
  • 2',3'-dideoxyadenosine triphosphate
  • 2',3'-dideoxyadenosine-5'-triphosphate
  • [(2s,5r)-5-(6-amino-9-purinyl)-2-tetrahydrofuranyl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2s,5r)-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • [(2s,5r)-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
  • [(2s,5r)-5-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]methyl (hydroxy-phosphonooxy-phosphoryl) hydrogen phosphate
  • adenosine 5'-(tetrahydrogen triphosphate), 2',3'-dideoxy-
  • dad
CAS Number(s)
  • 24027-80-3
  • 24028-04-4
InChIKey OAKPWEUQDVLTCN-NKWVEPMBSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C P O N