Adenosine 5′-(tetrahydrogen triphosphate), 2′-deoxy-, disodium salt
Properties
- Molecular formula
- C10H14N5Na2O12P3
- Molar mass
- 535.15 g/mol
- Exact mass
- 534.9647 Da
- logP
- -1.36Crippen estimate
- Polar surface area
- 258.9 Ų
- H-bond donors / acceptors
- 6 / 12
- Rotatable bonds
- 8
- Stereocentres
- R, S, Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
74299-50-6SMILES
Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP([O-])(=O)OP([O-])(=O)OP(=O)(O)O)O1.[Na+].[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Work with Adenosine 5′-(tetrahydrogen triphosphate), 2′-deoxy-, disodium salt
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Adenosine 5′-(trihydrogen diphosphate), 2′-deoxy-, sodium salt (1:2)72003-83-981 % similar
Deoxyadenosine monophosphate653-63-475 % similar
ATP disodium987-65-573 % similar
Deoxyadenosine 5′-monophosphate disodium salt2922-74-973 % similar
Sodium adenosine 5′-diphosphate20398-34-970 % similar
Inosine 5′-(tetrahydrogen triphosphate), 2′-deoxy-, trisodium salt95648-77-461 % similar
Cytidine 5′-(tetrahydrogen triphosphate), 2′-deoxy-, sodium salt (1:2)102783-51-760 % similar
Adenosine-5′-diphosphate disodium salt16178-48-658 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.