Acetonitrile → HCID 86587065, compound

HRID 351518Notes

Reaction equation

HRID 351518 reaction equation
[CH2:1]([O:3][CH:4]([CH2:14][C:15]1[CH:20]=[CH:19][C:18]([OH:21])=[CH:17][CH:16]=1)[C:5]([O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH3:13])=[O:6])[CH3:2].C(#N)C>P([O-])([O-])([O-])=O>[CH2:1]([O:3][C@@H:4]([CH2:14][C:15]1[CH:16]=[CH:17][C:18]([OH:21])=[CH:19][CH:20]=1)[C:5]([OH:7])=[O:6])[CH3:2].[CH2:1]([O:3][C@H:4]([CH2:14][C:15]1[CH:16]=[CH:17][C:18]([OH:21])=[CH:19][CH:20]=1)[C:5]([O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH3:13])=[O:6])[CH3:2]

Participants

4

Reactant 2

HCID 6342AcetonitrileHCID 85044960HCID 85044960, compound

Product 1

HCID 86587065HCID 86587065, compound

Reagents, catalysts & solvents 1

HCID 1061PhosphateSolvent2×

Procedure

To hexyl (2RS) (+/−) 2-ethoxy-3-(4-hydroxyphenyl)-propanoate (0.25 ml of a suspension containing 2 mg/ml in phosphate buffer 0.1M pH 7 and acetonitrile (amount indicated below)) was added the enzyme (amount indicated below) diluted in phosphate buffer 0.1M pH 7 (buffer volume such as total reaction mixture volume was 0.5 ml). The reaction mixture was shaken at room temperature and analysed at different times. The reaction mixture was analysed by the gradient HPLC method 1, and the chiral CE method 2.

Workup

  1. additionwas added the enzyme (amount indicated below)

Sources & evidence

ORD record
ord-b7303f050ab14d3184ffbe909d82072c
Source dataset
uspto-grants-2004_06
Patent number
US06743608B2

Reaction notes

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