Cas no 57817-57-9 (Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorofluoridic acid (9CI))

Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorofluoridic acid (9CI) structure
57817-57-9 structure
Product Name:Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorofluoridic acid (9CI)
CAS No:57817-57-9
MF:C10H15FN5O13P3
MW:525.171488046646
CID:371313
PubChem ID:135600310
Update Time:2025-04-19

Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorofluoridic acid (9CI) Chemical and Physical Properties

Names and Identifiers

    • Guanosine5'-(trihydrogen diphosphate), P'-anhydride with phosphorofluoridic acid (9CI)
    • [[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-fluorophosphinic acid
    • GTP(Gammaf)
    • 57817-57-9
    • Guanosine 5'-O-(gamma-fluorotriphosphate)
    • DTXSID80206528
    • Guanosine, 5'-(trihydrogen diphosphate), monoanhydride with phosphorofluoridic acid
    • Guanosine 5'-(gamma-fluorotriphosphate)
    • Inchi: 1S/C10H15FN5O13P3/c11-30(20,21)28-32(24,25)29-31(22,23)26-1-3-5(17)6(18)9(27-3)16-2-13-4-7(16)14-10(12)15-8(4)19/h2-3,5-6,9,17-18H,1H2,(H,20,21)(H,22,23)(H,24,25)(H3,12,14,15,19)/t3-,5-,6-,9-/m1/s1
    • InChI Key: BBORJPPPVGUNRB-UUOKFMHZSA-N
    • SMILES: P(=O)(O)(OP(=O)(O)OP(=O)(O)F)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(NC(N)=NC2=3)=O)O1)O)O

Computed Properties

  • Exact Mass: 524.98645
  • Monoisotopic Mass: 524.98632471g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 16
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 8
  • Complexity: 938
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -4.7
  • Topological Polar Surface Area: 275?2

Experimental Properties

  • PSA: 274.58
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