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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 612298Generated: November 1, 2026

Methanol → HCID 131721505, compound

https://huagongshe.com/reaction/612298

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethanolHCID 887—
Reactant4-MethylmorpholineHCID 7972—
ReactantPhosphorus pentachlorideHCID 24819—
ReactantHCID 131721506HCID 131721506—
SolventWaterHCID 962—
SolventDichloromethaneHCID 6344—
ProductHCID 131721505HCID 131721505—

Reaction Steps

A solution of 4-methoxybenzyl (6R,7R)-3-[(2RS,5SR)-5-methoxymethyltetrahydrofuran-2-yl]-7-phenoxyacetamidoceph-3-em-4-carboxylate (1.93 g) in dichloromethane (25 ml) was cooled to -15 to -20° C., N-methylmorpholine (0.75 ml) was added followed by a solution of phosphorus pentachloride in dichloromethane (26.5 ml of a solution containing 40 mg.ml-1). The mixture was stirred at the same temperature for 0.5 h and then methanol (6.8 ml) was added and the mixture stirred at room temperature for 0.5 h. Water (10 ml) was then added and the mixture vigorously stirred for 0.5 h. The dichloromethane was then removed on a rotary evaporator and the residue was partitioned between ether and water. The aqueous phase was stirred with ethyl acetate and the pH was adjusted to 6.2 with 1N aqueous ammonia. The organic phase was washed with water and brine, dried over magnesium sulphate and evaporated. The products were separated by column chromatography of the residue using gradient elution (silica gel, 1:1 hexane : ethyl acetate going to neat ethyl acetate). The following were obtained in order of elution 4-methoxybenzyl (6R,7R)-7-amino-3-[(2S,5R)-5-methoxy-methyltetrahydrofuran-2-yl]ceph-3-em-4-carboxylate (388 mg); νmax (CHCl3) 3410, 1776 and 1725 cm-1 ; δH (CDCl3) 1.59-1.78 (2 H,m), 1.93-2.08 (1 H,m), 2.18-2.32 (1 H,m), 2.54 (2 H, br s), 3.33-3.54 (3 H,m), 3.38 (3 H,s), 3.80 (3 H,s), 4.00-4.11 (1 H,m), 4.76 (1 H,d, J 4.99 Hz), 4.90 (1 H,d, J 4.97 Hz) 4.96 (1 H,t, J 8.23 Hz) 5.17 (2 H,s), 6.88 (2 H,d, J 8.60 Hz) and 7.33 (2 H,d, J 8.61 Hz). [Mass spectrum: M+ (434)]; 4-methoxybenzyl (6R,7R)-7-amino-3-((2R,5S)-5-methoxymethyltetrahydrofuran-2-yl]ceph-3-em-4-carboxylate (305 mg); νmax (CHCl3) 3409, 1776 and 1725 cm-1 ; δH (CDCl3) 1.60-1.81 (2 H, m), 1.85-2.01 (2 H, m), 3.30-3.50 (2 H, m), 3.38 (3 H, s), 3.44 (1 H,d, J 17.78 Hz), 3.69 (1 H, d, J 17.75 Hz), 3.80 (3 H, s), 4.00-4.17 (1 H,m), 4.70 (1 H, d, J 4.92 Hz), 4.93 (1 H, d, J 4.95 Hz), 5.10-5.20 (1 H, m), 5.18 (1 H, d, J 11.88 Hz), 5.24 (1 H, d, J 11.89 Hz), 6.88 (1 H,d, J 8.65 Hz) and 7.35 (1 H, d, J 8.64 Hz). [Mass spectrum: M+(434)].

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06001997
Source datasetuspto-grants-1999_12
ORD IDord-aa6147c38c164c0483e610f1243634e3
Source noteuspto-grants-1999_12