HuagongsheHuagongshe Chemistry Print Report · For research reference only
2',5'-Dideoxyadenosine
NSC 95943 · 2',5'-DD-ADO · 2',5'-Dideoxyadenosine · 2'',5''-Dideoxyadenosine · Adenosine, 2',5'-dideoxy- · 2'',5''-Dideoxyadenosine, 10 mM in DMSO · 2',5'-Dideoxyadenosine >=95% (HPLC), solid · 2,5-Dideoxyadenosine - CAS 6698-26-6 - Calbiochem
Identifiers & Physical Properties
| CAS No. | 6698-26-6 |
|---|---|
| Molecular formula | C10H13N5O2 |
| Average molar mass | 235.24 g/mol |
| Monoisotopic mass | 235.10692466 g/mol |
| SMILES | C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)C[C@@H]1O |
| InChIKey | FFHPXOJTVQDVMO-DSYKOEDSSA-N |
| PubChem CID | 65166 |
| ChEMBL | CHEMBL1253350 |
| ChEBI | CHEBI:195578 |
| DTXSID | DTXSID901364878 |
Chemical & Physical Properties
| XLogP | -0.1 |
|---|---|
| Topological polar surface area | 99.1 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 1 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 292 |
| Boiling point | 547.0±60.0 °C(Predicted) |
| Density | 1.77±0.1 g/cm3(Predicted) |
| Storage conditions | -20°C |
| Solubility | DMSO: soluble |
| Physical state | solid |
| pKa (acidity coefficient) | 14.06±0.60(Predicted) |
| Color | white |
| InChI | InChI=1S/C10H13N5O2/c1-5-6(16)2-7(17-5)15-4-14-8-9(11)12-3-13-10(8)15/h3-7,16H,2H2,1H3,(H2,11,12,13)/t5-,6+,7-/m1/s1 |
| InChIKey | FFHPXOJTVQDVMO-DSYKOEDSSA-N |
| SMILES | C[C@H]1O[C@@H](N2C3C(=C(N=CN=3)N)N=C2)C[C@@H]1O |
| FDA UNII | 988H339Z1L |
| UNSPSC Code | 41106305 |
| NACRES | NA.77 |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P261-P305+P351+P338 |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
| Water hazard class (WGK) | 3 |
| Customs code | 29349990 |
| Storage class | 11 - Combustible Solids |
Safety & Regulations
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
|---|---|
| Water hazard class (WGK) | 3 |
| Customs code | 29349990 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Storage class | 11 - Combustible Solids |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P261-P305+P351+P338 |
Applications & Uses
Uses
2′,5′-Dideoxyadenosine has been used to elucidate the mechanism of diligustilide (DLG). It has also been used to inhibit adenylate cyclase (AC).