Thioinosine

Molecule SVG Image

Properties Simple | Detailed

Formula C10H12N4O4S
IUPAC Name 9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-6-thione
Molecular Mass 284.292 g·mol−1
Heat of Formation 555.6 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 279.44 Å 3
Surface Area 266.96 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -3.24 ± eV
Point Group Symmetry C1
Synonyms
  • 6-mercapto-9beta-d-ribofuranosyl-9h-purine
  • 6-mercaptoinosine
  • 6-mercaptopurine 9beta-d-ribofuranoside
  • 6-mercaptopurine-9-beta-d-ribofuranoside
  • 6-purinethiol riboside
  • 6-thioinosine
  • 63830_fluka
  • 6h-purine-6-thione, 1,9-dihydro-9-beta-d-ribofuranosyl-
  • 6h-purine-6-thione, 1,9-dihydro-9-ribofuranosyl- (9ci)
  • 852686_aldrich
  • 9-.beta.-d-ribofuranosylpurine-6-thione
  • 9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-3h-purine-6-thione
  • 9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3h-purine-6-thione
  • 9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purine-6-thione
  • 9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-3h-purine-6-thione
  • 9-beta-d-ribofuranosyl-6-mercaptopurine
  • 9-beta-d-ribofuranosyl-9h-purine-6-thiol
  • 9h-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-
  • 9h-purine-6(1h)-thione, 9-beta-d-ribofuranosyl- (8ci)
  • 9h-purine-6(1h)-thione, 9-ribofuranosyl-
  • 9h-purine-6-thiol, 9-beta-d-ribofuranosyl-
  • 9h-purine-6-thiol, 9-beta-d-ribofuransoyl-
  • 9h-purine-6-thiol, 9-ribofuranosyl-
  • ai3-50220
  • aids-020980
  • aids020980
  • ccris 2763
  • d01678
  • einecs 209-371-5
  • inosine, 6-thio-
  • inosine, 6-thio- (9ci)
  • mercaptopurine ribonucleoside
  • mercaptopurine riboside
  • pdsp1_001039
  • pdsp2_001023
  • ribofuranoside, 9h-purine-6-thiol-9
  • thioinosine
  • thioinosine (jan)
  • thioinosine [jan]
CAS Number(s)
  • 5270-38-2
  • 653-58-7
  • 574-25-4
  • 4988-64-1
InChIKey NKGPJODWTZCHGF-KQYNXXCUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements S C O N