adenosine 5'-O-(2-thiodiphosphate)

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 49
Total Number of Articles : 53
PubChem 5310996
Molecular Formula

C10H15N5O9P2S

SMILES

C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=S)(O)O)O)O)N

InChI

InChI=1S/C10H15N5O9P2S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(23-10)1-22-25(18,19)24-26(20,21)27/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H2,20,21,27)/t4-,6-,7-,10-/m1/s1

synonyms
  • Adpbetas
  • adenosine 5'-O-(2-thiodiphosphate)
  • 35094-45-2
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Properties
Property Value
MW 443.27 g/mol
HBD 6
HBA 14
Rotatable Bond Count 6
Exact Mass 443.00657224 g/mol
Monoisotopic Mass 443.00657224 g/mol
Heavy Atom Count 27
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 642
xlogp -2.9
Topological Polar Surface Area 248