Zurück
HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 2040615Erstellt: 26. Oktober 2026

Acetic Acid → ethyl 3-(3-((((3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methyl)amino)cyclobutyl)propanoate

https://huagongshe.com/reaction/2040615

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktAcetic AcidHCID 176—
EduktSodium cyanoborohydrideHCID 5003444—
Edukt5'-Amino-5'-deoxy-2',3'-O-(1-methylethylidene)-adenosineHCID 11301215—
EduktEthyl 3-(3-oxocyclobutyl)propanoateHCID 67775333—
LösungsmittelMethanolHCID 887—
LösungsmittelWaterHCID 962—
Produktethyl 3-(3-((((3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methyl)amino)cyclobutyl)propanoateHCID 67774002—

Reaktionsschritte

A mixture of 9-((3aR,4R,6R,6aR)-6-(aminomethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-9H-purin-6-amine (2.04 g, 6.66 mmol) and ethyl 3-(3-oxocyclobutyl)propanoate (1.2 g, 7.0 mmol) in methanol (41 mL) was treated with acetic acid (0.37 mL, 6.5 mmol) at rt and the flask was evacuated and flushed with nitrogen (×3). The reaction mixture was treated at rt with sodium cyanoborohydride (1.0 g, 16 mmol), which afforded instant gas evolution and a nearly colorless, clear solution in a few minutes. The reaction mixture was stirred for 1 h at rt; HPLC/LC MS indicated starting material remained. At 1 h 20 min additional ethyl 3-(3-oxocyclobutyl)propanoate (0.50 g, 2.93 mmol) in MeOH (3 mL) was added. The reaction mixture was stirred for 30 min and treated with water (12 mL). The mixture was concentrated in vacuo and the residual aqueous layer was diluted with saturated aqueous sodium bicarbonate (40 mL, to pH 9) and extracted with CH2Cl2 (3×60 mL). The combined organics were dried (Na2SO4) and concentrated in vacuo to afford the crude title compound as a white foam/very pale yellow oil, which was carried on without further purification: MS (ESI+) for C22H32N6O5 m/z 461.2 (M+H)+ and 483.1 (M+Na)+.

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08580762B2
Quelldatensatzuspto-grants-2013_11
ORD IDord-02aaca7e52e642bc8c5c1598bc1c34a8
Quellennotizuspto-grants-2013_11