3'-(1-Butylphosphoryl)adenosine
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] butyl hydrogen phosphate
Also Known As: B-Factor|3'-(1-Butylphosphoryl)adenosine|3'-Adenylic acid, monobutyl ester|3'-Adenylic acid,monobutyl ester|3'-O-[Butoxy(hydroxy)phosphoryl]adenosine|[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] butyl hydrogen phosphate
| Molecular Formula | C14H22N5O7P |
|---|---|
| Molecular Weight | 403.12567 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.12567 |
| Monoisotopic Mass | 403.12567 |
| Heavy Atoms | 27 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 52278-63-4 |
|---|---|
| SMILES | CCCCOP(=O)(O)O[C@@H]1[C@H](O[C@H]([C@@H]1O)N2C=NC3=C(N=CN=C32)N)CO |
| InChIKey | RVVKQBUWQFREIE-IDTAVKCVSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-(1-Butylphosphoryl)adenosine (CAS 52278-63-4), with molecular formula C14H22N5O7P and molecular weight 403.12567 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] butyl hydrogen phosphate.
3'-(1-Butylphosphoryl)adenosine is a custom synthesis product. We offer services from milligram to kilogram scale.
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