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Ethyl Acetate → 4beta-Ethyl-6alpha-hydroxyandrostan-3,17-dione

HRID 1182892
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HRID 1182892 반응식
[CH2:1]([C@H:3]1[C@H:20]([OH:21])[CH2:19][CH2:18][C@@:17]2([CH3:22])[CH:4]1[C@@H:5]([OH:24])[CH2:6][C@@H:7]1[C@@H:16]2[CH2:15][CH2:14][C@@:12]2([CH3:13])[C@H:8]1[CH2:9][CH2:10][C@@H:11]2[OH:23])[CH3:2].C1C(=O)N(Br)C(=O)C1.CCOC(C)=O.[O-]S([O-])=O.[Na+].[Na+]>O1CCOCC1.O.N1C=CC=CC=1>[CH2:1]([C@H:3]1[C:20](=[O:21])[CH2:19][CH2:18][C@@:17]2([CH3:22])[CH:4]1[C@@H:5]([OH:24])[CH2:6][C@@H:7]1[C@@H:16]2[CH2:15][CH2:14][C@@:12]2([CH3:13])[C@H:8]1[CH2:9][CH2:10][C:11]2=[O:23])[CH3:2]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 4

HCID 8857Ethyl AcetateHCID 24437Sodium SulfiteHCID 67184N-bromobutanimideHCID 687790364beta-Ethylandrostan-3alpha,6alpha,17beta-triol

생성물 1

HCID 687318194beta-Ethyl-6alpha-hydroxyandrostan-3,17-dione수율 57.7%

시약·촉매·용매 3

HCID 962
Water
용매
2회
HCID 1049Pyridine용매
HCID 312751,4-Dioxane용매

실험 절차

To a stirred solution of 4β-ethylandrostan-3α,6α,17β-triol (Preparation 11, 237 mg) in dioxane (5.8 ml), water (1.08 ml), pyridine (0.1 ml) and NBS (249 mg) were added. After 72 h, EtOAc (70 ml), H2O (30 ml) and 10% Na2SO3 aqueous solution (24 ml) were added and the mixture was stirred for 10 min. The phases were separated and the aqueous phase was extracted with EtOAc. The combined organic extracts were washed with of 5% aqueous NaHCO3, brine, dried over MgSO4, filtered and evaporated to dryness. The crude product was purified by flash chromatography (SiO2, EtOAc/n-hexane 70/30) to give the title compound as a white solid (135 mg, 57%).

후처리

  1. customThe phases were separated
  2. extractionthe aqueous phase was extracted with EtOAc
  3. washThe combined organic extracts were washed with of 5% aqueous NaHCO3, brine
  4. dry with materialdried over MgSO4
  5. filtrationfiltered
  6. customevaporated to dryness
  7. customThe crude product was purified by flash chromatography (SiO2, EtOAc/n-hexane 70/30)

출처 및 근거

ORD 기록
ord-504bc999511d4d709eb81275e0f5ab63
출처 데이터셋
uspto-grants-2014_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08664210B2

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